Molecule_SMILES	Molecule_inchikey	Augmented_Scaffold_inchikey	Augmented_Scaffold_SMILES	Augmented_Framework_inchikey	Augmented_Framework_smiles	Augmented_Wireframe_inchikey	Augmented_Wireframe_smiles	Decorated_Scaffold_inchikey	Decorated_Scaffold_SMILES	Decorated_Framework_inchikey	Decorated_Framework_SMILES	Decorated_Wireframe_inchikey	Decorated_Wireframe_SMILES	Basic_Scaffold_inchikey	Basic_Scaffold_SMILES	Basic_Framework_inchikey	Basic_Framework_SMILES	Basic_Wireframe_inchikey	Basic_Wireframe_SMILES
Clc1ccc(cc1)n2cc(CSc3nc4ccccc4s3)nn2	CXULESWTJMNWGC-UHFFFAOYSA-N	CWGFCMHLMRNDRV-UHFFFAOYSA-N	C(Sc1nc2ccccc2s1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4	CWGFCMHLMRNDRV-UHFFFAOYSA-N	C(Sc1nc2ccccc2s1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4	CWGFCMHLMRNDRV-UHFFFAOYSA-N	C(Sc1nc2ccccc2s1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4
CCC(=O)NS(=O)(=O)c1ccc(cc1CO)n2nc(cc2c3ccc(OC)c(C)c3)C(F)(F)F	SEOLPERUYVBGEQ-UHFFFAOYSA-N	UPPVXKJSRFTPNF-UHFFFAOYSA-N	CCC(=O)NS(=O)(=O)c1ccc(cc1)n2nccc2c3ccc(OC)cc3	YAIAPSYPRXRZLO-UHFFFAOYSA-N	CCC(=C)C[C](=C)(=C)c1ccc(cc1)C2C=CC=C2c3ccc(CC)cc3	ROTODRQKYXKAAE-UHFFFAOYSA-N	CCC(C)CC(C)(C)C1CCC(CC1)C2CCCC2C3CCC(CC)CC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
NS(=O)(=O)c1ccc(NC(=O)CCN2C(=O)NC(C2=O)(c3ccccc3)c4ccccc4)cc1	IWYSIRLFOMZCSF-UHFFFAOYSA-N	FYDNAESVNQFJSQ-UHFFFAOYSA-N	O=C(CCN1C(=O)NC(C1=O)(c2ccccc2)c3ccccc3)Nc4ccccc4	QSSHVTMCVPPCDR-UHFFFAOYSA-N	C=C(CCC1C(=C)CC(C1=C)(c2ccccc2)c3ccccc3)Cc4ccccc4	RRPXJELMWKAFMN-UHFFFAOYSA-N	CC(CCC1C(C)CC(C2CCCCC2)(C3CCCCC3)C1C)CC4CCCCC4	FYDNAESVNQFJSQ-UHFFFAOYSA-N	O=C(CCN1C(=O)NC(C1=O)(c2ccccc2)c3ccccc3)Nc4ccccc4	QSSHVTMCVPPCDR-UHFFFAOYSA-N	C=C(CCC1C(=C)CC(C1=C)(c2ccccc2)c3ccccc3)Cc4ccccc4	RRPXJELMWKAFMN-UHFFFAOYSA-N	CC(CCC1C(C)CC(C2CCCCC2)(C3CCCCC3)C1C)CC4CCCCC4	NMHMXZFBPUOFDP-UHFFFAOYSA-N	C(CNc1ccccc1)CN2CNC(C2)(c3ccccc3)c4ccccc4	QJZRUTBGXWHIFM-UHFFFAOYSA-N	C(CCc1ccccc1)CC2CCC(C2)(c3ccccc3)c4ccccc4	HZSUWJDKGHJTBF-UHFFFAOYSA-N	C(CCC1CCC(C1)(C2CCCCC2)C3CCCCC3)CC4CCCCC4
COc1ccc2c(c1)c(CC(=O)NCCc3ccccc3)c(C)n2C(=O)c4ccc(Cl)cc4	VYDBTNADENXYSN-UHFFFAOYSA-N	YSJQREKMAOJAEH-UHFFFAOYSA-N	COc1ccc2c(c1)c(CC(=O)NCCc3ccccc3)c(C)n2C(=O)c4ccccc4	MMOBYMZJWCDTRF-UHFFFAOYSA-N	CCc1ccc2C(C(=C)c3ccccc3)C(=C(CC(=C)CCCc4ccccc4)c2c1)C	URVHMSAKYNLIAI-UHFFFAOYSA-N	CCC1CCC2C(C1)C(CC(C)CCCC3CCCCC3)C(C)C2C(C)C4CCCCC4	ZTDMSJZIQOUYBC-UHFFFAOYSA-N	O=C(Cc1cn(C(=O)c2ccccc2)c3ccccc13)NCCc4ccccc4	YZZPEIKFDIIYFC-UHFFFAOYSA-N	C=C(CCCc1ccccc1)CC2=CC(C(=C)c3ccccc3)c4ccccc24	JISXAQMLAMDCBH-UHFFFAOYSA-N	CC(CCCC1CCCCC1)CC2CC(C(C)C3CCCCC3)C4CCCCC24	PQYIXRHVASJRJX-UHFFFAOYSA-N	C(Cc1ccccc1)NCCc2cn(Cc3ccccc3)c4ccccc24	NRSWUWPXPGXPIY-UHFFFAOYSA-N	C(CCC1=CC(Cc2ccccc2)c3ccccc13)CCc4ccccc4	RDJSMZIQIGBCCT-UHFFFAOYSA-N	C(CCC1CCCCC1)CCC2CC(CC3CCCCC3)C4CCCCC24
Fc1ccc(cc1)n2cc(CSc3nc4ccccc4s3)nn2	AEUZPURMUGHSJT-UHFFFAOYSA-N	CWGFCMHLMRNDRV-UHFFFAOYSA-N	C(Sc1nc2ccccc2s1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4	CWGFCMHLMRNDRV-UHFFFAOYSA-N	C(Sc1nc2ccccc2s1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4	CWGFCMHLMRNDRV-UHFFFAOYSA-N	C(Sc1nc2ccccc2s1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4
NS(=O)(=O)c1ccc(CNC(=O)CN2C(=O)NC(C2=O)(c3ccccc3)c4ccccc4)cc1	NGZCUAPCJNBUEU-UHFFFAOYSA-N	CIBHYXOIDMJEHH-UHFFFAOYSA-N	O=C(CN1C(=O)NC(C1=O)(c2ccccc2)c3ccccc3)NCc4ccccc4	QTJUFZXOCLQOTH-UHFFFAOYSA-N	C=C(CCc1ccccc1)CC2C(=C)CC(C2=C)(c3ccccc3)c4ccccc4	YWCGGILQEYDJLQ-UHFFFAOYSA-N	CC(CCC1CCCCC1)CC2C(C)CC(C3CCCCC3)(C4CCCCC4)C2C	CIBHYXOIDMJEHH-UHFFFAOYSA-N	O=C(CN1C(=O)NC(C1=O)(c2ccccc2)c3ccccc3)NCc4ccccc4	QTJUFZXOCLQOTH-UHFFFAOYSA-N	C=C(CCc1ccccc1)CC2C(=C)CC(C2=C)(c3ccccc3)c4ccccc4	YWCGGILQEYDJLQ-UHFFFAOYSA-N	CC(CCC1CCCCC1)CC2C(C)CC(C3CCCCC3)(C4CCCCC4)C2C	HFTSMDCLUKZGKT-UHFFFAOYSA-N	C(CN1CNC(C1)(c2ccccc2)c3ccccc3)NCc4ccccc4	QJZRUTBGXWHIFM-UHFFFAOYSA-N	C(CCc1ccccc1)CC2CCC(C2)(c3ccccc3)c4ccccc4	HZSUWJDKGHJTBF-UHFFFAOYSA-N	C(CCC1CCC(C1)(C2CCCCC2)C3CCCCC3)CC4CCCCC4
COc1ccc2c(c1)c(CC(=O)Nc3ccc(NC(=O)C)cc3)c(C)n2C(=O)c4ccc(Cl)cc4	CVMUUPNNEPVQCL-UHFFFAOYSA-N	SJOYKPHEJAAHGW-UHFFFAOYSA-N	COc1ccc2c(c1)c(CC(=O)Nc3ccc(NC(=O)C)cc3)cn2C(=O)c4ccccc4	XJBFGPYRRFMKGE-UHFFFAOYSA-N	CCc1ccc2C(C=C(CC(=C)Cc3ccc(CC(=C)C)cc3)c2c1)C(=C)c4ccccc4	AHDBFOWTDUBZJM-UHFFFAOYSA-N	CCC1CCC2C(CC(CC(C)CC3CCC(CC(C)C)CC3)C2C1)C(C)C4CCCCC4	ZDDMUQNBZSUXID-UHFFFAOYSA-N	O=C(Cc1cn(C(=O)c2ccccc2)c3ccccc13)Nc4ccccc4	LYPBLYTZDWBADB-UHFFFAOYSA-N	C=C(CC1=CC(C(=C)c2ccccc2)c3ccccc13)Cc4ccccc4	JQXCJNLLYVYADG-UHFFFAOYSA-N	CC(CC1CCCCC1)CC2CC(C(C)C3CCCCC3)C4CCCCC24	ACXCRVBPPZEWJE-UHFFFAOYSA-N	C(Cc1cn(Cc2ccccc2)c3ccccc13)Nc4ccccc4	VBOMXPURCSNBIQ-UHFFFAOYSA-N	C(CC1=CC(Cc2ccccc2)c3ccccc13)Cc4ccccc4	PBDCMJIIKWPFFY-UHFFFAOYSA-N	C(CC1CCCCC1)CC2CC(CC3CCCCC3)C4CCCCC24
COc1cc(CNC(=O)CN2C(=O)NC(C2=O)(c3ccccc3)c4ccccc4)cc(OC)c1OC	WIABGRDVOBDKBC-UHFFFAOYSA-N	DCLLMQOORPZMBM-UHFFFAOYSA-N	COc1cc(CNC(=O)CN2C(=O)NC(C2=O)(c3ccccc3)c4ccccc4)cc(OC)c1	ZDCYRRNVFZZQLA-UHFFFAOYSA-N	CCc1cc(CC)cc(CCC(=C)CC2C(=C)CC(C2=C)(c3ccccc3)c4ccccc4)c1	IJFUUAQHALIOHT-UHFFFAOYSA-N	CCC1CC(CC)CC(CCC(C)CC2C(C)CC(C3CCCCC3)(C4CCCCC4)C2C)C1	CIBHYXOIDMJEHH-UHFFFAOYSA-N	O=C(CN1C(=O)NC(C1=O)(c2ccccc2)c3ccccc3)NCc4ccccc4	QTJUFZXOCLQOTH-UHFFFAOYSA-N	C=C(CCc1ccccc1)CC2C(=C)CC(C2=C)(c3ccccc3)c4ccccc4	YWCGGILQEYDJLQ-UHFFFAOYSA-N	CC(CCC1CCCCC1)CC2C(C)CC(C3CCCCC3)(C4CCCCC4)C2C	HFTSMDCLUKZGKT-UHFFFAOYSA-N	C(CN1CNC(C1)(c2ccccc2)c3ccccc3)NCc4ccccc4	QJZRUTBGXWHIFM-UHFFFAOYSA-N	C(CCc1ccccc1)CC2CCC(C2)(c3ccccc3)c4ccccc4	HZSUWJDKGHJTBF-UHFFFAOYSA-N	C(CCC1CCC(C1)(C2CCCCC2)C3CCCCC3)CC4CCCCC4
Cc1ccnc(c1)C(=O)c2[nH]c3cc(F)ccc3c2CC(=O)O	SZQLJRUPQGEKLC-UHFFFAOYSA-N	LRPXSQXHCBZVJE-UHFFFAOYSA-N	CCc1c([nH]c2ccccc12)C(=O)c3cc(C)ccn3	UXBQWLWEMKXMCO-UHFFFAOYSA-N	CCC1=C(Cc2ccccc12)C(=C)c3cccc(C)c3	GLPCPVIHQKXCQU-UHFFFAOYSA-N	CCC1C(CC2CCCCC12)C(C)C3CCCC(C)C3	INXMOYLZSTUBBF-UHFFFAOYSA-N	O=C(c1ccccn1)c2cc3ccccc3[nH]2	RAQMQRROXUZNQZ-UHFFFAOYSA-N	C=C(C1=Cc2ccccc2C1)c3ccccc3	OFEXKFLZBGKZPR-UHFFFAOYSA-N	CC(C1CCCCC1)C2CC3CCCCC3C2	ANVQGHPFUNSAPE-UHFFFAOYSA-N	C(c1ccccn1)c2cc3ccccc3[nH]2	QAUQHTFRJMMRFK-UHFFFAOYSA-N	C(C1=Cc2ccccc2C1)c3ccccc3	XZBRWXZCNFGWHM-UHFFFAOYSA-N	C(C1CCCCC1)C2CC3CCCCC3C2
COc1ccc(cc1C)c2cc(nn2c3ccc(c(CO)c3)S(=O)(=O)N)C(F)F	LIUNJVOSPPFGRN-UHFFFAOYSA-N	XUIJZBCRKSUREG-UHFFFAOYSA-N	COc1ccc(cc1)c2ccnn2c3cccc(C)c3	BATVNZQAYKULNG-UHFFFAOYSA-N	CCc1ccc(cc1)C2=CC=CC2c3cccc(C)c3	LUUKASHRPHGFSJ-UHFFFAOYSA-N	CCC1CCC(CC1)C2CCCC2C3CCCC(C)C3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
CN1C(=C(O[99Tc])c2ccccc2S1(=O)=O)C(=O)Nc3ncc(C)s3	HVUCORFBPMYYOL-IEOVAKBOSA-M	LNMUBFOHPNPHAY-UHFFFAOYSA-N	CN1C(=Cc2ccccc2S1(=O)=O)C(=O)Nc3ncc(C)s3	PSUMKEMMVGAYIC-UHFFFAOYSA-N	CC1C(=Cc2ccccc2[C]1(=C)=C)C(=C)CC3=CC=C(C)C3	BNCSJSGEMMOJAM-UHFFFAOYSA-N	CC(CC1CCC(C)C1)C2CC3CCCCC3C(C)(C)C2C	APLYXBGBLPACES-UHFFFAOYSA-N	O=C(Nc1nccs1)C2=Cc3ccccc3S(=O)(=O)N2	ZSDIWUJMQPZWQT-UHFFFAOYSA-N	C=C(CC1=CC=CC1)C2=Cc3ccccc3[C](=C)(=C)C2	WLPVXVFHJADZSE-UHFFFAOYSA-N	CC(CC1CCCC1)C2CC3CCCCC3C(C)(C)C2	IZNQCLXCNKAUBA-UHFFFAOYSA-N	C(Nc1nccs1)C2=Cc3ccccc3SN2	GWRSHCASULVZGB-UHFFFAOYSA-N	C(CC1=Cc2ccccc2CC1)C3=CC=CC3	RRWRVNAZMSRQMV-UHFFFAOYSA-N	C(CC1CCC2CCCCC2C1)C3CCCC3
CS(=O)(=O)c1ccc(cc1)n2cc(nc2c3cccc(Cl)c3)C(F)(F)F	YLFBPUKBMRJHLM-UHFFFAOYSA-N	HFTQQSCEXQTGNI-UHFFFAOYSA-N	Cc1cn(c2ccc(cc2)S(=O)(=O)C)c(n1)c3ccccc3	TVVMMWHELHZBDT-UHFFFAOYSA-N	CC1=CC(C(=C1)c2ccccc2)c3ccc(cc3)[C](=C)(=C)C	XFTBKNXYSSNWEK-UHFFFAOYSA-N	CC1CC(C2CCCCC2)C(C1)C3CCC(CC3)C(C)(C)C	JNZXFLAEEPPCSN-UHFFFAOYSA-N	c1ccc(cc1)c2nccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	JNZXFLAEEPPCSN-UHFFFAOYSA-N	c1ccc(cc1)c2nccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
NS(=O)(=O)c1ccc(cc1)N2N=C(CC2c3ccc(F)cc3F)C(F)(F)F	ZZMJXWXXMAAPLI-UHFFFAOYSA-N	FZTOIOYDPXSQDM-UHFFFAOYSA-N	CC1=NN(C(C1)c2ccccc2)c3ccccc3	JPKJTLYVSMFMLP-UHFFFAOYSA-N	CC1=CC(C(C1)c2ccccc2)c3ccccc3	DWJLFZJGQUHKKP-UHFFFAOYSA-N	CC1CC(C2CCCCC2)C(C1)C3CCCCC3	OQYNUZDJQMOTFA-UHFFFAOYSA-N	C1C=NN(C1c2ccccc2)c3ccccc3	RTBDRLYNZOJMMV-UHFFFAOYSA-N	C1C=CC(C1c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	OQYNUZDJQMOTFA-UHFFFAOYSA-N	C1C=NN(C1c2ccccc2)c3ccccc3	RTBDRLYNZOJMMV-UHFFFAOYSA-N	C1C=CC(C1c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
Fc1ccc(NC(=O)CSC2=Nc3ccccc3C(=O)N2CCc4ccccn4)cc1	UEHUAZSKQBFLTL-UHFFFAOYSA-N	OOBUMGXGIDIWFF-UHFFFAOYSA-N	O=C(CSC1=Nc2ccccc2C(=O)N1CCc3ccccn3)Nc4ccccc4	ZUPNALWWHBINJL-UHFFFAOYSA-N	C=C(CCC1=Cc2ccccc2C(=C)C1CCc3ccccc3)Cc4ccccc4	BNBIIRFJPODYEX-UHFFFAOYSA-N	CC(CCC1CC2CCCCC2C(C)C1CCC3CCCCC3)CC4CCCCC4	OOBUMGXGIDIWFF-UHFFFAOYSA-N	O=C(CSC1=Nc2ccccc2C(=O)N1CCc3ccccn3)Nc4ccccc4	ZUPNALWWHBINJL-UHFFFAOYSA-N	C=C(CCC1=Cc2ccccc2C(=C)C1CCc3ccccc3)Cc4ccccc4	BNBIIRFJPODYEX-UHFFFAOYSA-N	CC(CCC1CC2CCCCC2C(C)C1CCC3CCCCC3)CC4CCCCC4	RYKTUHDADUZJHT-UHFFFAOYSA-N	C(CSC1=Nc2ccccc2CN1CCc3ccccn3)Nc4ccccc4	DRGUOWULRVKCQA-UHFFFAOYSA-N	C(CCc1ccccc1)CC2=Cc3ccccc3CC2CCc4ccccc4	YOUUAGLMIDJAAJ-UHFFFAOYSA-N	C(CCC1CC2CCCCC2CC1CCC3CCCCC3)CC4CCCCC4
CC\C=C\C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\CCC(=O)N1CC(O)CC1C(=O)O	ZACWGPMSIRFUMQ-SFGLVEFQSA-N	FFFDQFKUFUGBTJ-DMGWNJAXSA-N	CC\C=C\C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\CCC(=O)N1CCCC1C	PSYGJWDKIGJBHU-YATCGRJWSA-N	CC\C=C\C\C=C\C\C=C\C\C=C\C\C=C\C\C=C\CCC(=C)C1CCCC1C	OTNPUFHVIGUCTC-UHFFFAOYSA-N	CCCCCCCCCCCCCCCCCCCCCC(C)C1CCCC1C	RWRDLPDLKQPQOW-UHFFFAOYSA-N	C1CCNC1	RGSFGYAAUTVSQA-UHFFFAOYSA-N	C1CCCC1	RGSFGYAAUTVSQA-UHFFFAOYSA-N	C1CCCC1	RWRDLPDLKQPQOW-UHFFFAOYSA-N	C1CCNC1	RGSFGYAAUTVSQA-UHFFFAOYSA-N	C1CCCC1	RGSFGYAAUTVSQA-UHFFFAOYSA-N	C1CCCC1
COc1cc(NC(=O)CSC2=Nc3ccccc3C(=O)N2CCc4ccccn4)cc(OC)c1OC	YNMXZGHQHZPKPB-UHFFFAOYSA-N	PRPGUCHRZXFYDI-UHFFFAOYSA-N	COc1cc(NC(=O)CSC2=Nc3ccccc3C(=O)N2CCc4ccccn4)cc(OC)c1	SADBRATXTRCYQG-UHFFFAOYSA-N	CCc1cc(CC)cc(CC(=C)CCC2=Cc3ccccc3C(=C)C2CCc4ccccc4)c1	WWYHEJCZANXLLH-UHFFFAOYSA-N	CCC1CC(CC)CC(CC(C)CCC2CC3CCCCC3C(C)C2CCC4CCCCC4)C1	OOBUMGXGIDIWFF-UHFFFAOYSA-N	O=C(CSC1=Nc2ccccc2C(=O)N1CCc3ccccn3)Nc4ccccc4	ZUPNALWWHBINJL-UHFFFAOYSA-N	C=C(CCC1=Cc2ccccc2C(=C)C1CCc3ccccc3)Cc4ccccc4	BNBIIRFJPODYEX-UHFFFAOYSA-N	CC(CCC1CC2CCCCC2C(C)C1CCC3CCCCC3)CC4CCCCC4	RYKTUHDADUZJHT-UHFFFAOYSA-N	C(CSC1=Nc2ccccc2CN1CCc3ccccn3)Nc4ccccc4	DRGUOWULRVKCQA-UHFFFAOYSA-N	C(CCc1ccccc1)CC2=Cc3ccccc3CC2CCc4ccccc4	YOUUAGLMIDJAAJ-UHFFFAOYSA-N	C(CCC1CC2CCCCC2CC1CCC3CCCCC3)CC4CCCCC4
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CS(=O)(=O)Nc1ccc(cc1Sc2ccc(Cl)cc2Cl)S(=O)(=O)N	DKZMGRFLBPFIJG-UHFFFAOYSA-N	LRGLUGGLXFKISK-UHFFFAOYSA-N	CS(=O)(=O)Nc1ccccc1Sc2ccccc2	GKNBLKXNCCYGSK-UHFFFAOYSA-N	C[C](=C)(=C)Cc1ccccc1Cc2ccccc2	RETPDFYORYWNLG-UHFFFAOYSA-N	CC(C)(C)CC1CCCCC1CC2CCCCC2	LTYMSROWYAPPGB-UHFFFAOYSA-N	S(c1ccccc1)c2ccccc2	CZZYITDELCSZES-UHFFFAOYSA-N	C(c1ccccc1)c2ccccc2	XXKOQQBKBHUATC-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCCC2	LTYMSROWYAPPGB-UHFFFAOYSA-N	S(c1ccccc1)c2ccccc2	CZZYITDELCSZES-UHFFFAOYSA-N	C(c1ccccc1)c2ccccc2	XXKOQQBKBHUATC-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCCC2
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CC(C)OC(=O)OCOC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl	CWFSRKOXOMBPCI-UHFFFAOYSA-N	GBUKRYYCAUWQQX-UHFFFAOYSA-N	CCOC(=O)OCOC(=O)Cc1ccccc1Nc2ccccc2	LWAPLOCRTDFHGT-UHFFFAOYSA-N	CCCC(=C)CCCC(=C)Cc1ccccc1Cc2ccccc2	YQHYJWKDODKCAH-UHFFFAOYSA-N	CCCC(C)CCCC(C)CC1CCCCC1CC2CCCCC2	DMBHHRLKUKUOEG-UHFFFAOYSA-N	N(c1ccccc1)c2ccccc2	CZZYITDELCSZES-UHFFFAOYSA-N	C(c1ccccc1)c2ccccc2	XXKOQQBKBHUATC-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCCC2	DMBHHRLKUKUOEG-UHFFFAOYSA-N	N(c1ccccc1)c2ccccc2	CZZYITDELCSZES-UHFFFAOYSA-N	C(c1ccccc1)c2ccccc2	XXKOQQBKBHUATC-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCCC2
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CC(=O)\C(=C(/C(=O)O)\c1ccccc1)\c2ccc(cc2)S(=O)(=O)C	YERKTYCNJYWPRD-WUKNDPDISA-N	XFGFMJDYTTWHOL-ATVHPVEESA-N	CC(=O)C(=Cc1ccccc1)c2ccc(cc2)S(=O)(=O)C	RDEUTKRTWYWHEI-HKWRFOASSA-N	CC(=C)C(=Cc1ccccc1)c2ccc(cc2)[C](=C)(=C)C	KMIXYGDEPBBYFT-UHFFFAOYSA-N	CC(C)C(CC1CCCCC1)C2CCC(CC2)C(C)(C)C	PJANXHGTPQOBST-UHFFFAOYSA-N	C(=Cc1ccccc1)c2ccccc2	PJANXHGTPQOBST-UHFFFAOYSA-N	C(=Cc1ccccc1)c2ccccc2	IBLVSWYGUFGDMF-UHFFFAOYSA-N	C(CC1CCCCC1)C2CCCCC2	PJANXHGTPQOBST-UHFFFAOYSA-N	C(=Cc1ccccc1)c2ccccc2	PJANXHGTPQOBST-UHFFFAOYSA-N	C(=Cc1ccccc1)c2ccccc2	IBLVSWYGUFGDMF-UHFFFAOYSA-N	C(CC1CCCCC1)C2CCCCC2
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CC(C)Cc1ccc(cc1)C(C)C(=O)OCCCCO[N+](=O)[O-]	UVZIMMIABQVMNX-UHFFFAOYSA-N	CFLKUCVVCZYITR-UHFFFAOYSA-N	CCCCOC(=O)Cc1ccc(CCC)cc1	AVWSOSAIXLASSX-UHFFFAOYSA-N	CCCCCC(=C)Cc1ccc(CCC)cc1	OQJHTFFDZJZLCB-UHFFFAOYSA-N	CCCCCC(C)CC1CCC(CCC)CC1	UHOVQNZJYSORNB-UHFFFAOYSA-N	c1ccccc1	UHOVQNZJYSORNB-UHFFFAOYSA-N	c1ccccc1	XDTMQSROBMDMFD-UHFFFAOYSA-N	C1CCCCC1	UHOVQNZJYSORNB-UHFFFAOYSA-N	c1ccccc1	UHOVQNZJYSORNB-UHFFFAOYSA-N	c1ccccc1	XDTMQSROBMDMFD-UHFFFAOYSA-N	C1CCCCC1
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Cc1ccc(cc1)c2cc(nn2c3ccc(cc3)S(=O)(=O)N)C([18F])(F)F	RZEKVGVHFLEQIL-SQZVAGKESA-N	WLAQNRPOJULDLH-UHFFFAOYSA-N	Cc1ccc(cc1)c2cc(C)nn2c3ccccc3	QCYPGCDDGWQZQH-UHFFFAOYSA-N	CC1=CC(C(=C1)c2ccc(C)cc2)c3ccccc3	XMMUAAVCUBHJKL-UHFFFAOYSA-N	CC1CCC(CC1)C2CC(C)CC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
CS(=O)(=O)c1ccc(cc1)n2nccc2c3ccc(cc3)[N+](=O)[O-]	FDGGENUUUSWYLR-UHFFFAOYSA-N	ZYYJXAHNQZTWJP-UHFFFAOYSA-N	CS(=O)(=O)c1ccc(cc1)n2nccc2c3ccccc3	UQCSGTVLFBNCJC-UHFFFAOYSA-N	C[C](=C)(=C)c1ccc(cc1)C2C=CC=C2c3ccccc3	YQMUFFMIOHTPMX-UHFFFAOYSA-N	CC(C)(C)C1CCC(CC1)C2CCCC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
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COc1ccc2cc(ccc2c1)C(C)CN3CCC[C@H]3CO	FVRLPWPHJCQIOD-IBYPIGCZSA-N	HREWHWUFEILUJX-CQSZACIVSA-N	COc1ccc2cc(CCN3CCC[C@H]3C)ccc2c1	DNWDYZSMFDIOPF-NNJIEVJOSA-N	CCc1ccc2cc(CCC3CCCC3C)ccc2c1	ONFRFVSMUIOVHQ-UHFFFAOYSA-N	CCC1CCC2CC(CCC3CCCC3C)CCC2C1	BUFGWZZSSJWXIJ-UHFFFAOYSA-N	C(Cc1ccc2ccccc2c1)N3CCCC3	SQRIGHNECCGLEO-UHFFFAOYSA-N	C(Cc1ccc2ccccc2c1)C3CCCC3	RRWRVNAZMSRQMV-UHFFFAOYSA-N	C(CC1CCC2CCCCC2C1)C3CCCC3	BUFGWZZSSJWXIJ-UHFFFAOYSA-N	C(Cc1ccc2ccccc2c1)N3CCCC3	SQRIGHNECCGLEO-UHFFFAOYSA-N	C(Cc1ccc2ccccc2c1)C3CCCC3	RRWRVNAZMSRQMV-UHFFFAOYSA-N	C(CC1CCC2CCCCC2C1)C3CCCC3
COc1ccc(cc1F)c2cc(nn2c3ccc(cc3)S(=O)(=O)N)C(F)F	WAZQAZKAZLXFMK-UHFFFAOYSA-N	VCNWTJZNWICFOB-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(C)nn2c3ccccc3	QNWNEZGWNOBXDL-UHFFFAOYSA-N	CCc1ccc(cc1)C2=CC(=CC2c3ccccc3)C	IKXNPNYNXZNIBV-UHFFFAOYSA-N	CCC1CCC(CC1)C2CC(C)CC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
CC(CN1CCCC1)c2ccc(c(F)c2)c3ccccc3	OKDKWKGEVYLREX-UHFFFAOYSA-N	GRAXKTUTTAGVNC-UHFFFAOYSA-N	CC(CN1CCCC1)c2ccc(cc2)c3ccccc3	UDJLVKWAUDCYIK-UHFFFAOYSA-N	CC(CC1CCCC1)c2ccc(cc2)c3ccccc3	IOUOXRMBGLVWPY-UHFFFAOYSA-N	CC(CC1CCCC1)C2CCC(CC2)C3CCCCC3	CFLKFYMJEJGVAB-UHFFFAOYSA-N	C(Cc1ccc(cc1)c2ccccc2)N3CCCC3	VHAQWTSUUCPMJM-UHFFFAOYSA-N	C(Cc1ccc(cc1)c2ccccc2)C3CCCC3	XAAYPULXIQLNTB-UHFFFAOYSA-N	C(CC1CCC(CC1)C2CCCCC2)C3CCCC3	CFLKFYMJEJGVAB-UHFFFAOYSA-N	C(Cc1ccc(cc1)c2ccccc2)N3CCCC3	VHAQWTSUUCPMJM-UHFFFAOYSA-N	C(Cc1ccc(cc1)c2ccccc2)C3CCCC3	XAAYPULXIQLNTB-UHFFFAOYSA-N	C(CC1CCC(CC1)C2CCCCC2)C3CCCC3
CSc1ncc(c2ccc(cc2)S(=O)(=O)C)n1c3ccc(Br)cc3	DIXLGMOZFUYROY-UHFFFAOYSA-N	NYNJGJOFSOTWCH-UHFFFAOYSA-N	CSc1ncc(c2ccc(cc2)S(=O)(=O)C)n1c3ccccc3	FBFHRMXFPSQGSK-UHFFFAOYSA-N	CCC1=CC=C(C1c2ccccc2)c3ccc(cc3)[C](=C)(=C)C	JJFZSSVAXIALOJ-UHFFFAOYSA-N	CCC1CCC(C2CCC(CC2)C(C)(C)C)C1C3CCCCC3	JBLLBGIUSCXVSG-UHFFFAOYSA-N	c1ccc(cc1)c2cncn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	JBLLBGIUSCXVSG-UHFFFAOYSA-N	c1ccc(cc1)c2cncn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
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Cc1c(CC(=O)OCCO)cc(c2ccc(cc2)S(=O)(=O)C)n1c3cccc(F)c3	FZCWJSIRPYGSIE-UHFFFAOYSA-N	SMPHZIYYJVLUGK-UHFFFAOYSA-N	CCOC(=O)Cc1cc(c2ccc(cc2)S(=O)(=O)C)n(c1)c3ccccc3	DCCDQQMABMDJOW-UHFFFAOYSA-N	CCCC(=C)CC1=CC(C(=C1)c2ccc(cc2)[C](=C)(=C)C)c3ccccc3	YIARJNPMANFHBY-UHFFFAOYSA-N	CCCC(C)CC1CC(C2CCCCC2)C(C1)C3CCC(CC3)C(C)(C)C	ZZDIPNSMKJPHTR-UHFFFAOYSA-N	c1ccc(cc1)c2cccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	ZZDIPNSMKJPHTR-UHFFFAOYSA-N	c1ccc(cc1)c2cccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
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CC(=O)Nc1ccc(OC(=O)c2c3CCCCc3sc2c4ccccc4)cc1	RVKSXSPRODCURZ-UHFFFAOYSA-N	RVKSXSPRODCURZ-UHFFFAOYSA-N	CC(=O)Nc1ccc(OC(=O)c2c3CCCCc3sc2c4ccccc4)cc1	CCNULXVRSGJHJX-UHFFFAOYSA-N	CC(=C)Cc1ccc(CC(=C)C2=C(CC3=C2CCCC3)c4ccccc4)cc1	QQTUFGLCMAVAON-UHFFFAOYSA-N	CC(C)CC1CCC(CC(C)C2C3CCCCC3CC2C4CCCCC4)CC1	XLWRSOKDLGQODT-UHFFFAOYSA-N	O=C(Oc1ccccc1)c2c3CCCCc3sc2c4ccccc4	YRJOEQLZRCSZQP-UHFFFAOYSA-N	C=C(Cc1ccccc1)C2=C(CC3=C2CCCC3)c4ccccc4	MYILFVRBKKLFHK-UHFFFAOYSA-N	CC(CC1CCCCC1)C2C3CCCCC3CC2C4CCCCC4	NUMJLSKGHXYIQG-UHFFFAOYSA-N	C(Oc1ccccc1)c2c3CCCCc3sc2c4ccccc4	NWHQJGWCEGGPJK-UHFFFAOYSA-N	C(Cc1ccccc1)C2=C(CC3=C2CCCC3)c4ccccc4	FOBIAKUVDZPLPT-UHFFFAOYSA-N	C(CC1C2CCCCC2CC1C3CCCCC3)C4CCCCC4
Cc1cccc(Nc2ccccc2C(=O)NCCN3CCNCC3)c1C	IKCKPUMFQODPSP-UHFFFAOYSA-N	IKCKPUMFQODPSP-UHFFFAOYSA-N	Cc1cccc(Nc2ccccc2C(=O)NCCN3CCNCC3)c1C	FWTDHAGUTWKWQR-UHFFFAOYSA-N	Cc1cccc(Cc2ccccc2C(=C)CCCC3CCCCC3)c1C	NDRSNSWZWQRRSR-UHFFFAOYSA-N	CC(CCCC1CCCCC1)C2CCCCC2CC3CCCC(C)C3C	BLUBVCFWEKSHTG-UHFFFAOYSA-N	O=C(NCCN1CCNCC1)c2ccccc2Nc3ccccc3	XWILQOWKUNGNNB-UHFFFAOYSA-N	C=C(CCCC1CCCCC1)c2ccccc2Cc3ccccc3	JHVBPOZMTMYLOE-UHFFFAOYSA-N	CC(CCCC1CCCCC1)C2CCCCC2CC3CCCCC3	JHMDHUVUYXFCSD-UHFFFAOYSA-N	C(CN1CCNCC1)NCc2ccccc2Nc3ccccc3	RSOIUMLNIKEVIA-UHFFFAOYSA-N	C(CCc1ccccc1Cc2ccccc2)CC3CCCCC3	DRCRKPSSZHGPSG-UHFFFAOYSA-N	C(CCC1CCCCC1CC2CCCCC2)CC3CCCCC3
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COc1ccc(cc1)C2=Nc3ccccc3C(=O)N2c4ccc(cc4)S(=O)(=O)C	OAFPKJPUJZKQDL-UHFFFAOYSA-N	OAFPKJPUJZKQDL-UHFFFAOYSA-N	COc1ccc(cc1)C2=Nc3ccccc3C(=O)N2c4ccc(cc4)S(=O)(=O)C	KFOJIAUAQOIBIS-UHFFFAOYSA-N	CCc1ccc(cc1)C2=Cc3ccccc3C(=C)C2c4ccc(cc4)[C](=C)(=C)C	FFNLGXXQPUYOSW-UHFFFAOYSA-N	CCC1CCC(CC1)C2CC3CCCCC3C(C)C2C4CCC(CC4)C(C)(C)C	RSKPIJGOGQGETI-UHFFFAOYSA-N	O=C1N(C(=Nc2ccccc12)c3ccccc3)c4ccccc4	NCRIZWRBVLBJAJ-UHFFFAOYSA-N	C=C1C(C(=Cc2ccccc12)c3ccccc3)c4ccccc4	LFWIOYJGZMAFKD-UHFFFAOYSA-N	CC1C2CCCCC2CC(C3CCCCC3)C1C4CCCCC4	FLZKTHGXZQJKDZ-UHFFFAOYSA-N	C1N(C(=Nc2ccccc12)c3ccccc3)c4ccccc4	SRRABFUMFKGGIT-UHFFFAOYSA-N	C1C(C(=Cc2ccccc12)c3ccccc3)c4ccccc4	ZSPLAXJBIFTUGP-UHFFFAOYSA-N	C1CCC(CC1)C2CC3CCCCC3CC2C4CCCCC4
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Clc1ccc(cc1)n2cc(CSc3oc4ccccc4n3)nn2	ZMUUYQXIXHEHKH-UHFFFAOYSA-N	HXHAORASBJPZEG-UHFFFAOYSA-N	C(Sc1oc2ccccc2n1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4	HXHAORASBJPZEG-UHFFFAOYSA-N	C(Sc1oc2ccccc2n1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4	HXHAORASBJPZEG-UHFFFAOYSA-N	C(Sc1oc2ccccc2n1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4
COc1ccc(cc1)c2cc(nn2c3ccc(cc3F)S(=O)(=O)N)C(F)(F)F	OHIVDQMFQYBGDC-UHFFFAOYSA-N	VCNWTJZNWICFOB-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(C)nn2c3ccccc3	QNWNEZGWNOBXDL-UHFFFAOYSA-N	CCc1ccc(cc1)C2=CC(=CC2c3ccccc3)C	IKXNPNYNXZNIBV-UHFFFAOYSA-N	CCC1CCC(CC1)C2CC(C)CC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
Brc1ccc(cc1)n2cc(CSc3oc4ccccc4n3)nn2	OTDKTRHTEFHXBU-UHFFFAOYSA-N	HXHAORASBJPZEG-UHFFFAOYSA-N	C(Sc1oc2ccccc2n1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4	HXHAORASBJPZEG-UHFFFAOYSA-N	C(Sc1oc2ccccc2n1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4	HXHAORASBJPZEG-UHFFFAOYSA-N	C(Sc1oc2ccccc2n1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4
COc1ccc(cc1OC)C2=NN(C(=O)c3ccccc23)c4ccc(cc4)S(=O)(=O)N	CXTHTVQIXLFASD-UHFFFAOYSA-N	UKAVKUHTIJNYEZ-UHFFFAOYSA-N	COc1ccc(cc1OC)C2=NN(C(=O)c3ccccc23)c4ccccc4	FWBOSHYELIUZKS-UHFFFAOYSA-N	CCc1ccc(cc1CC)C2=CC(C(=C)c3ccccc23)c4ccccc4	RMIYSQDAARAADC-UHFFFAOYSA-N	CCC1CCC(CC1CC)C2CC(C3CCCCC3)C(C)C4CCCCC24	SEMJODDJJQASLF-UHFFFAOYSA-N	O=C1N(N=C(c2ccccc2)c3ccccc13)c4ccccc4	AFUJCLXTHIDEFG-UHFFFAOYSA-N	C=C1C(C=C(c2ccccc2)c3ccccc13)c4ccccc4	QYJYIJUJZRSRLO-UHFFFAOYSA-N	CC1C2CCCCC2C(CC1C3CCCCC3)C4CCCCC4	NGLSEBITPLKNMS-UHFFFAOYSA-N	C1N(N=C(c2ccccc2)c3ccccc13)c4ccccc4	HNQLMCKVCYVHBN-UHFFFAOYSA-N	C1C(C=C(c2ccccc2)c3ccccc13)c4ccccc4	NZRDVOMWSCUAQI-UHFFFAOYSA-N	C1CCC(CC1)C2CC3CCCCC3C(C2)C4CCCCC4
CCOc1ccc(cc1)n2cc(CSc3oc4ccccc4n3)nn2	QWWOBXJJZBGRKO-UHFFFAOYSA-N	QWWOBXJJZBGRKO-UHFFFAOYSA-N	CCOc1ccc(cc1)n2cc(CSc3oc4ccccc4n3)nn2	ZIFYITKAWFAMFJ-UHFFFAOYSA-N	CCCc1ccc(cc1)C2C=CC(=C2)CCC3=Cc4ccccc4C3	FDCVAATWJUOLJH-UHFFFAOYSA-N	CCCC1CCC(CC1)C2CCC(CCC3CC4CCCCC4C3)C2	HXHAORASBJPZEG-UHFFFAOYSA-N	C(Sc1oc2ccccc2n1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4	HXHAORASBJPZEG-UHFFFAOYSA-N	C(Sc1oc2ccccc2n1)c3cn(nn3)c4ccccc4	MZXZEMVDWNCXCU-UHFFFAOYSA-N	C(CC1=CC(C=C1)c2ccccc2)C3=Cc4ccccc4C3	CIQOUQXIQUYWIC-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCC(C3)C4CCCCC4
CCC(=O)NS(=O)(=O)c1ccc(c(F)c1)n2nc(cc2c3ccc(OC)cc3)C(F)(F)F	UGWFUQIQLBYZAY-UHFFFAOYSA-N	UPPVXKJSRFTPNF-UHFFFAOYSA-N	CCC(=O)NS(=O)(=O)c1ccc(cc1)n2nccc2c3ccc(OC)cc3	YAIAPSYPRXRZLO-UHFFFAOYSA-N	CCC(=C)C[C](=C)(=C)c1ccc(cc1)C2C=CC=C2c3ccc(CC)cc3	ROTODRQKYXKAAE-UHFFFAOYSA-N	CCC(C)CC(C)(C)C1CCC(CC1)C2CCCC2C3CCC(CC)CC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
CCOC(=O)c1c(C)oc2ccc(Oc3ccc(C)cc3)cc12	CUHTUSNYDQACPN-UHFFFAOYSA-N	AVCIYRNTRWLRHY-UHFFFAOYSA-N	CCOC(=O)c1coc2ccc(Oc3ccc(C)cc3)cc12	AMPIUESXJVUXGA-UHFFFAOYSA-N	CCCC(=C)C1=CCc2ccc(Cc3ccc(C)cc3)cc12	FIYNPYDQHSAORZ-UHFFFAOYSA-N	CCCC(C)C1CCC2CCC(CC3CCC(C)CC3)CC12	AAIXHGSTYUAFSZ-UHFFFAOYSA-N	O(c1ccccc1)c2ccc3occc3c2	VJPGDTVPUMZYGU-UHFFFAOYSA-N	C(c1ccccc1)c2ccc3CC=Cc3c2	BVDQHJOLQLJALX-UHFFFAOYSA-N	C(C1CCCCC1)C2CCC3CCCC3C2	AAIXHGSTYUAFSZ-UHFFFAOYSA-N	O(c1ccccc1)c2ccc3occc3c2	VJPGDTVPUMZYGU-UHFFFAOYSA-N	C(c1ccccc1)c2ccc3CC=Cc3c2	BVDQHJOLQLJALX-UHFFFAOYSA-N	C(C1CCCCC1)C2CCC3CCCC3C2
CS(=O)(=O)c1ccc(nc1)n2nc(cc2c3ccccc3)C(F)F	LNEWNCVYPLKLFQ-UHFFFAOYSA-N	FTNKNXBGGMCJHS-UHFFFAOYSA-N	Cc1cc(c2ccccc2)n(n1)c3ccc(cn3)S(=O)(=O)C	TVVMMWHELHZBDT-UHFFFAOYSA-N	CC1=CC(C(=C1)c2ccccc2)c3ccc(cc3)[C](=C)(=C)C	XFTBKNXYSSNWEK-UHFFFAOYSA-N	CC1CC(C2CCCCC2)C(C1)C3CCC(CC3)C(C)(C)C	PJWKYGDGDHWBSI-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccn3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	PJWKYGDGDHWBSI-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccn3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
NC(=S)c1ccc(cc1)n2nc(cc2c3ccc(F)cc3)C(F)(F)F	UWBPJLSLAOHMJB-UHFFFAOYSA-N	ADFWKUQHVCGINV-UHFFFAOYSA-N	Cc1ccc(cc1)n2nc(C)cc2c3ccccc3	DEALTMTWMKLMDY-UHFFFAOYSA-N	CC1=CC(C(=C1)c2ccccc2)c3ccc(C)cc3	XMMUAAVCUBHJKL-UHFFFAOYSA-N	CC1CCC(CC1)C2CC(C)CC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
O=C1Nc2ccccc2/C/1=C/C3=COc4ccccc4C3=O	DAFFBWCJVXCNBW-ZROIWOOFSA-N	DAFFBWCJVXCNBW-ZROIWOOFSA-N	O=C1Nc2ccccc2/C/1=C/C3=COc4ccccc4C3=O	NVDPCKSRPIBMSE-HYARGMPZSA-N	C=C1Cc2ccccc2/C/1=C/C3=CCc4ccccc4C3=C	CJAZSDWNJQBDEL-UHFFFAOYSA-N	CC1CC2CCCCC2C1CC3CCC4CCCCC4C3C	DAFFBWCJVXCNBW-ZROIWOOFSA-N	O=C1Nc2ccccc2/C/1=C/C3=COc4ccccc4C3=O	NVDPCKSRPIBMSE-HYARGMPZSA-N	C=C1Cc2ccccc2/C/1=C/C3=CCc4ccccc4C3=C	CJAZSDWNJQBDEL-UHFFFAOYSA-N	CC1CC2CCCCC2C1CC3CCC4CCCCC4C3C	HFKBVXNSLRHZFQ-XNTDXEJSSA-N	C1Nc2ccccc2/C/1=C/C3=COc4ccccc4C3	NKZRWFVDIGVINL-XMHGGMMESA-N	C1Cc2ccccc2/C/1=C/C3=CCc4ccccc4C3	HYHGQDDYILEQRT-UHFFFAOYSA-N	C(C1CCC2CCCCC2C1)C3CCC4CCCCC34
Cc1ccc(cc1)c2cc(nn2c3ccc(cc3)C(=S)N)C(F)(F)F	DLUIPPLWXZORGW-UHFFFAOYSA-N	ALYRXCQPAMPKJP-UHFFFAOYSA-N	Cc1ccc(cc1)c2ccnn2c3ccc(C)cc3	GILYNOUEXWIHOF-UHFFFAOYSA-N	Cc1ccc(cc1)C2C=CC=C2c3ccc(C)cc3	NSLLZILUZRJCBU-UHFFFAOYSA-N	CC1CCC(CC1)C2CCCC2C3CCC(C)CC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
COc1ccc(cc1Cl)c2ccccc2c3oc4ccccc4n3	BMYKGYMFFKYRJH-UHFFFAOYSA-N	RPNWWLKDYPWPDL-UHFFFAOYSA-N	COc1ccc(cc1)c2ccccc2c3oc4ccccc4n3	RJLXFKHARCRJKU-UHFFFAOYSA-N	CCc1ccc(cc1)c2ccccc2C3=Cc4ccccc4C3	JYSQOVYIXVBOAE-UHFFFAOYSA-N	CCC1CCC(CC1)C2CCCCC2C3CC4CCCCC4C3	BPKRUANIHQGWMO-UHFFFAOYSA-N	o1c(nc2ccccc12)c3ccccc3c4ccccc4	BHAFZZGVLHFLRZ-UHFFFAOYSA-N	C1C(=Cc2ccccc12)c3ccccc3c4ccccc4	VBLGUKXOXKTHIP-UHFFFAOYSA-N	C1CCC(CC1)C2CCCCC2C3CC4CCCCC4C3	BPKRUANIHQGWMO-UHFFFAOYSA-N	o1c(nc2ccccc12)c3ccccc3c4ccccc4	BHAFZZGVLHFLRZ-UHFFFAOYSA-N	C1C(=Cc2ccccc12)c3ccccc3c4ccccc4	VBLGUKXOXKTHIP-UHFFFAOYSA-N	C1CCC(CC1)C2CCCCC2C3CC4CCCCC4C3
COc1ccc2c(c1)c(CC(=O)NC(O)Cc3ccccc3)c(C)n2C(=O)c4ccc(Cl)cc4	AIUSZASLWVMSGU-UHFFFAOYSA-N	YSJQREKMAOJAEH-UHFFFAOYSA-N	COc1ccc2c(c1)c(CC(=O)NCCc3ccccc3)c(C)n2C(=O)c4ccccc4	MMOBYMZJWCDTRF-UHFFFAOYSA-N	CCc1ccc2C(C(=C)c3ccccc3)C(=C(CC(=C)CCCc4ccccc4)c2c1)C	URVHMSAKYNLIAI-UHFFFAOYSA-N	CCC1CCC2C(C1)C(CC(C)CCCC3CCCCC3)C(C)C2C(C)C4CCCCC4	ZTDMSJZIQOUYBC-UHFFFAOYSA-N	O=C(Cc1cn(C(=O)c2ccccc2)c3ccccc13)NCCc4ccccc4	YZZPEIKFDIIYFC-UHFFFAOYSA-N	C=C(CCCc1ccccc1)CC2=CC(C(=C)c3ccccc3)c4ccccc24	JISXAQMLAMDCBH-UHFFFAOYSA-N	CC(CCCC1CCCCC1)CC2CC(C(C)C3CCCCC3)C4CCCCC24	PQYIXRHVASJRJX-UHFFFAOYSA-N	C(Cc1ccccc1)NCCc2cn(Cc3ccccc3)c4ccccc24	NRSWUWPXPGXPIY-UHFFFAOYSA-N	C(CCC1=CC(Cc2ccccc2)c3ccccc13)CCc4ccccc4	RDJSMZIQIGBCCT-UHFFFAOYSA-N	C(CCC1CCCCC1)CCC2CC(CC3CCCCC3)C4CCCCC24
Cc1[nH]c2cc(ccc2c1Oc3ccc(F)cc3)S(=O)(=O)C	VHSYYXRBWBHMNB-UHFFFAOYSA-N	JCMZXHDHZGEWAY-UHFFFAOYSA-N	Cc1[nH]c2cc(ccc2c1Oc3ccccc3)S(=O)(=O)C	DAMAQWPCPFVTRC-UHFFFAOYSA-N	CC1=C(Cc2ccccc2)c3ccc(cc3C1)[C](=C)(=C)C	FBPHNZWBJMUWKE-UHFFFAOYSA-N	CC1CC2CC(CCC2C1CC3CCCCC3)C(C)(C)C	RWDHLNIGJBRRBQ-UHFFFAOYSA-N	O(c1ccccc1)c2c[nH]c3ccccc23	BGLQFLIZWKWFBT-UHFFFAOYSA-N	C(C1=CCc2ccccc12)c3ccccc3	YFVAAXAVNYXVIE-UHFFFAOYSA-N	C(C1CCCCC1)C2CCC3CCCCC23	RWDHLNIGJBRRBQ-UHFFFAOYSA-N	O(c1ccccc1)c2c[nH]c3ccccc23	BGLQFLIZWKWFBT-UHFFFAOYSA-N	C(C1=CCc2ccccc12)c3ccccc3	YFVAAXAVNYXVIE-UHFFFAOYSA-N	C(C1CCCCC1)C2CCC3CCCCC23
CS(=O)(=O)c1ccc(cc1)c2ccccc2c3oc4ccccc4n3	TWACCSCUXLTNIQ-UHFFFAOYSA-N	TWACCSCUXLTNIQ-UHFFFAOYSA-N	CS(=O)(=O)c1ccc(cc1)c2ccccc2c3oc4ccccc4n3	HWEBKFKUVFGPBW-UHFFFAOYSA-N	C[C](=C)(=C)c1ccc(cc1)c2ccccc2C3=Cc4ccccc4C3	TYKFWGUJRDOGOD-UHFFFAOYSA-N	CC(C)(C)C1CCC(CC1)C2CCCCC2C3CC4CCCCC4C3	BPKRUANIHQGWMO-UHFFFAOYSA-N	o1c(nc2ccccc12)c3ccccc3c4ccccc4	BHAFZZGVLHFLRZ-UHFFFAOYSA-N	C1C(=Cc2ccccc12)c3ccccc3c4ccccc4	VBLGUKXOXKTHIP-UHFFFAOYSA-N	C1CCC(CC1)C2CCCCC2C3CC4CCCCC4C3	BPKRUANIHQGWMO-UHFFFAOYSA-N	o1c(nc2ccccc12)c3ccccc3c4ccccc4	BHAFZZGVLHFLRZ-UHFFFAOYSA-N	C1C(=Cc2ccccc12)c3ccccc3c4ccccc4	VBLGUKXOXKTHIP-UHFFFAOYSA-N	C1CCC(CC1)C2CCCCC2C3CC4CCCCC4C3
FC(F)(F)c1cc(c2ccc(Br)cc2)n(n1)c3ccc(cc3)C#N	RRGORDHJLLMSHA-UHFFFAOYSA-N	ADFWKUQHVCGINV-UHFFFAOYSA-N	Cc1ccc(cc1)n2nc(C)cc2c3ccccc3	DEALTMTWMKLMDY-UHFFFAOYSA-N	CC1=CC(C(=C1)c2ccccc2)c3ccc(C)cc3	XMMUAAVCUBHJKL-UHFFFAOYSA-N	CC1CCC(CC1)C2CC(C)CC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
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COc1cc2occc2c(OC)c1c3cc(c4ccc(cc4)C(F)(F)F)n(n3)c5ccc(cc5)S(=O)(=O)N	RTDWEGLAYPOTJQ-UHFFFAOYSA-N	ZFVCOFKRSBODIE-UHFFFAOYSA-N	COc1cc2occc2cc1c3cc(c4ccc(C)cc4)n(n3)c5ccccc5	OQGVIVXFWADCBZ-UHFFFAOYSA-N	CCc1cc2CC=Cc2cc1C3=CC(C(=C3)c4ccc(C)cc4)c5ccccc5	JSHRUFONKZIUGW-UHFFFAOYSA-N	CCC1CC2CCCC2CC1C3CC(C4CCCCC4)C(C3)C5CCC(C)CC5	ZIOXNEYOFFOCNG-UHFFFAOYSA-N	o1ccc2cc(ccc12)c3cc(c4ccccc4)n(n3)c5ccccc5	LBYUISARDMXWRL-UHFFFAOYSA-N	C1C=Cc2cc(ccc12)C3=CC(C(=C3)c4ccccc4)c5ccccc5	LHWVUGGQOPDZDK-UHFFFAOYSA-N	C1CCC(CC1)C2CC(CC2C3CCCCC3)C4CCC5CCCC5C4	ZIOXNEYOFFOCNG-UHFFFAOYSA-N	o1ccc2cc(ccc12)c3cc(c4ccccc4)n(n3)c5ccccc5	LBYUISARDMXWRL-UHFFFAOYSA-N	C1C=Cc2cc(ccc12)C3=CC(C(=C3)c4ccccc4)c5ccccc5	LHWVUGGQOPDZDK-UHFFFAOYSA-N	C1CCC(CC1)C2CC(CC2C3CCCCC3)C4CCC5CCCC5C4
NC(=S)c1ccc(cc1)n2nc(cc2c3occc3)C(F)(F)F	QOMKEZLUCGAMMC-UHFFFAOYSA-N	UGVVRMPIIUGXII-UHFFFAOYSA-N	Cc1ccc(cc1)n2nc(C)cc2c3occc3	UUORFJOLKULCIX-UHFFFAOYSA-N	CC1=CC(C(=C1)C2=CC=CC2)c3ccc(C)cc3	FWNQFIZYQDKGIO-UHFFFAOYSA-N	CC1CCC(CC1)C2CC(C)CC2C3CCCC3	VWFWKGKWNYIUEZ-UHFFFAOYSA-N	o1cccc1c2ccnn2c3ccccc3	KQIPWNHMHVLFJA-UHFFFAOYSA-N	C1C=CC=C1C2=CC=CC2c3ccccc3	BTFYOWGZUKZIQE-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCC3	VWFWKGKWNYIUEZ-UHFFFAOYSA-N	o1cccc1c2ccnn2c3ccccc3	KQIPWNHMHVLFJA-UHFFFAOYSA-N	C1C=CC=C1C2=CC=CC2c3ccccc3	BTFYOWGZUKZIQE-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCC3
Cc1nn(c2ccc(cc2)S(=O)(=O)N)c3c4cc(ccc4NC(=O)c13)[N+](=O)[O-]	RXAIKPJKKYQFCO-UHFFFAOYSA-N	HENBVGAVRDHGBK-UHFFFAOYSA-N	Cc1nn(c2ccccc2)c3c4ccccc4NC(=O)c13	IHZLDCFIXOLFPG-UHFFFAOYSA-N	CC1=CC(C2=C1C(=C)Cc3ccccc23)c4ccccc4	FWGHDOBOEWZBOS-UHFFFAOYSA-N	CC1CC2CCCCC2C3C(CC(C)C13)C4CCCCC4	QCFFVSKBKMDKLO-UHFFFAOYSA-N	O=C1Nc2ccccc2c3c1cnn3c4ccccc4	WUPQQDYDRGOSAA-UHFFFAOYSA-N	C=C1Cc2ccccc2C3=C1C=CC3c4ccccc4	KEBSIBLIYFZGDL-UHFFFAOYSA-N	CC1CC2CCCCC2C3C1CCC3C4CCCCC4	CEVBJPQJOLGITG-UHFFFAOYSA-N	C1Nc2ccccc2c3c1cnn3c4ccccc4	KOUXHNLJDBEQQE-UHFFFAOYSA-N	C1Cc2ccccc2C3=C1C=CC3c4ccccc4	ZWARHYMEAJPROH-UHFFFAOYSA-N	C1CCC(CC1)C2CCC3CCC4CCCCC4C23
CCOC(=O)c1c(C)oc2ccc(Oc3ccccc3C)cc12	YVLZYNAQMBQWED-UHFFFAOYSA-N	MNORDLDCTBAFLE-UHFFFAOYSA-N	CCOC(=O)c1coc2ccc(Oc3ccccc3C)cc12	WPEDCUFLXZTGBM-UHFFFAOYSA-N	CCCC(=C)C1=CCc2ccc(Cc3ccccc3C)cc12	RQKOAUIJORSKGV-UHFFFAOYSA-N	CCCC(C)C1CCC2CCC(CC3CCCCC3C)CC12	AAIXHGSTYUAFSZ-UHFFFAOYSA-N	O(c1ccccc1)c2ccc3occc3c2	VJPGDTVPUMZYGU-UHFFFAOYSA-N	C(c1ccccc1)c2ccc3CC=Cc3c2	BVDQHJOLQLJALX-UHFFFAOYSA-N	C(C1CCCCC1)C2CCC3CCCC3C2	AAIXHGSTYUAFSZ-UHFFFAOYSA-N	O(c1ccccc1)c2ccc3occc3c2	VJPGDTVPUMZYGU-UHFFFAOYSA-N	C(c1ccccc1)c2ccc3CC=Cc3c2	BVDQHJOLQLJALX-UHFFFAOYSA-N	C(C1CCCCC1)C2CCC3CCCC3C2
CC(C)CNc1nc(cc(n1)C(F)(F)F)c2ccc(cc2)S(=O)(=O)C	HOLQWJFBSBMDCC-UHFFFAOYSA-N	VBGHVVAKLXPLMD-UHFFFAOYSA-N	CCCNc1nccc(n1)c2ccc(cc2)S(=O)(=O)C	PBYIKTBIVQWMGB-UHFFFAOYSA-N	CCCCc1cccc(c1)c2ccc(cc2)[C](=C)(=C)C	JPLBJYLFGPLMCA-UHFFFAOYSA-N	CCCCC1CCCC(C1)C2CCC(CC2)C(C)(C)C	MKLQPIYLZMLAER-UHFFFAOYSA-N	c1ccc(cc1)c2ccncn2	ZUOUZKKEUPVFJK-UHFFFAOYSA-N	c1ccc(cc1)c2ccccc2	WVIIMZNLDWSIRH-UHFFFAOYSA-N	C1CCC(CC1)C2CCCCC2	MKLQPIYLZMLAER-UHFFFAOYSA-N	c1ccc(cc1)c2ccncn2	ZUOUZKKEUPVFJK-UHFFFAOYSA-N	c1ccc(cc1)c2ccccc2	WVIIMZNLDWSIRH-UHFFFAOYSA-N	C1CCC(CC1)C2CCCCC2
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O=C1CC(=NN1)Nc2ccccc2Nc3ccc(nn3)N4CCOCC4	OVBXTCFARXRFSK-UHFFFAOYSA-N	OVBXTCFARXRFSK-UHFFFAOYSA-N	O=C1CC(=NN1)Nc2ccccc2Nc3ccc(nn3)N4CCOCC4	AZSRCUJAEURJNY-UHFFFAOYSA-N	C=C1CC=C(Cc2ccccc2Cc3ccc(cc3)C4CCCCC4)C1	KQKNGSCCCQGYRT-UHFFFAOYSA-N	CC1CCC(CC2CCCCC2CC3CCC(CC3)C4CCCCC4)C1	OVBXTCFARXRFSK-UHFFFAOYSA-N	O=C1CC(=NN1)Nc2ccccc2Nc3ccc(nn3)N4CCOCC4	AZSRCUJAEURJNY-UHFFFAOYSA-N	C=C1CC=C(Cc2ccccc2Cc3ccc(cc3)C4CCCCC4)C1	KQKNGSCCCQGYRT-UHFFFAOYSA-N	CC1CCC(CC2CCCCC2CC3CCC(CC3)C4CCCCC4)C1	CPBLNKNIEYYHND-UHFFFAOYSA-N	C1CC(=NN1)Nc2ccccc2Nc3ccc(nn3)N4CCOCC4	HOVPRAMKKJRCDU-UHFFFAOYSA-N	C(C1=CCCC1)c2ccccc2Cc3ccc(cc3)C4CCCCC4	PWPRYERBJHZAJL-UHFFFAOYSA-N	C(C1CCCC1)C2CCCCC2CC3CCC(CC3)C4CCCCC4
CS(=O)(=O)c1ccc(cc1)c2nccnc2c3ccccc3	VPFPZWIWCHWHJI-UHFFFAOYSA-N	VPFPZWIWCHWHJI-UHFFFAOYSA-N	CS(=O)(=O)c1ccc(cc1)c2nccnc2c3ccccc3	KMFBVOBTDDNASX-UHFFFAOYSA-N	C[C](=C)(=C)c1ccc(cc1)c2ccccc2c3ccccc3	QVBYXIXYKOPKSQ-UHFFFAOYSA-N	CC(C)(C)C1CCC(CC1)C2CCCCC2C3CCCCC3	PTZIVVDMBCVSMR-UHFFFAOYSA-N	c1ccc(cc1)c2nccnc2c3ccccc3	OIAQMFOKAXHPNH-UHFFFAOYSA-N	c1ccc(cc1)c2ccccc2c3ccccc3	JSVILEFZXZLOES-UHFFFAOYSA-N	C1CCC(CC1)C2CCCCC2C3CCCCC3	PTZIVVDMBCVSMR-UHFFFAOYSA-N	c1ccc(cc1)c2nccnc2c3ccccc3	OIAQMFOKAXHPNH-UHFFFAOYSA-N	c1ccc(cc1)c2ccccc2c3ccccc3	JSVILEFZXZLOES-UHFFFAOYSA-N	C1CCC(CC1)C2CCCCC2C3CCCCC3
Clc1ccccc1Nc2ccc(Nc3ccccc3NC4=NNC(=O)C4)nn2	UQIVJMGZEVNQOP-UHFFFAOYSA-N	SSKHBPMYPRPQCV-UHFFFAOYSA-N	O=C1CC(=NN1)Nc2ccccc2Nc3ccc(Nc4ccccc4)nn3	ZCNIFWFDRVDRCC-UHFFFAOYSA-N	C=C1CC=C(Cc2ccccc2Cc3ccc(Cc4ccccc4)cc3)C1	KFBRUMBCWJDMPU-UHFFFAOYSA-N	CC1CCC(CC2CCCCC2CC3CCC(CC4CCCCC4)CC3)C1	SSKHBPMYPRPQCV-UHFFFAOYSA-N	O=C1CC(=NN1)Nc2ccccc2Nc3ccc(Nc4ccccc4)nn3	ZCNIFWFDRVDRCC-UHFFFAOYSA-N	C=C1CC=C(Cc2ccccc2Cc3ccc(Cc4ccccc4)cc3)C1	KFBRUMBCWJDMPU-UHFFFAOYSA-N	CC1CCC(CC2CCCCC2CC3CCC(CC4CCCCC4)CC3)C1	JCNPYVXSPIRLFY-UHFFFAOYSA-N	C1CC(=NN1)Nc2ccccc2Nc3ccc(Nc4ccccc4)nn3	AEEMJGADBWUEOX-UHFFFAOYSA-N	C(c1ccccc1)c2ccc(Cc3ccccc3CC4=CCCC4)cc2	YSWWFSSRIJDWQW-UHFFFAOYSA-N	C(C1CCCCC1)C2CCC(CC3CCCCC3CC4CCCC4)CC2
[2H]C([2H])([2H])c1cc(Br)cc2C=C(C(Oc12)C(F)(F)F)C(=O)O	ILHUJLLYTPMLPK-FIBGUPNXSA-N	UNSRMDRNXYJHAJ-UHFFFAOYSA-N	CC1=Cc2cccc(C)c2OC1	ZCFZOSNJSOVDCC-UHFFFAOYSA-N	CC1=Cc2cccc(C)c2CC1	SXLVBBLVYUOSKX-UHFFFAOYSA-N	CC1CCC2C(C)CCCC2C1	KYNSBQPICQTCGU-UHFFFAOYSA-N	C1Oc2ccccc2C=C1	KEIFWROAQVVDBN-UHFFFAOYSA-N	C1Cc2ccccc2C=C1	NNBZCPXTIHJBJL-UHFFFAOYSA-N	C1CCC2CCCCC2C1	KYNSBQPICQTCGU-UHFFFAOYSA-N	C1Oc2ccccc2C=C1	KEIFWROAQVVDBN-UHFFFAOYSA-N	C1Cc2ccccc2C=C1	NNBZCPXTIHJBJL-UHFFFAOYSA-N	C1CCC2CCCCC2C1
CC(C)Cc1ccc(cc1)C(C)C(=O)OCC\C(=C(\C)/N(CC(=O)OCC(OC(=O)C(C)c2ccc(CC(C)C)cc2)C3OC(=O)C(=C3O)O)C=O)\SSCc4ccccc4	DRBSSRQDAHYRIF-BZDUDJNJSA-N	NZVREVZMRBFHKJ-MDAYZVFASA-N	CCCc1ccc(CC(=O)OCCC(=CNCC(=O)OCC(OC(=O)Cc2ccc(CCC)cc2)C3OC(=O)C=C3)SSCc4ccccc4)cc1	SKPLVFOJYMWTEZ-SEMVAEAYSA-N	CCCc1ccc(CC(=C)CCCC(=CCCC(=C)CCC(CC(=C)Cc2ccc(CCC)cc2)C3CC(=C)C=C3)CCCc4ccccc4)cc1	JETCNSYABSOLFF-UHFFFAOYSA-N	CCCC1CCC(CC(C)CCCC(CCCC(C)CCC(CC(C)CC2CCC(CCC)CC2)C3CCC(C)C3)CCCC4CCCCC4)CC1	MTNVABUKHNKSAV-UHFFFAOYSA-N	O=C(CNC=C(CCOC(=O)Cc1ccccc1)SSCc2ccccc2)OCC(OC(=O)Cc3ccccc3)C4OC(=O)C=C4	KSESUZUOTXBMLY-UHFFFAOYSA-N	C=C(CCC=C(CCCC(=C)Cc1ccccc1)CCCc2ccccc2)CCC(CC(=C)Cc3ccccc3)C4CC(=C)C=C4	MTACMASYQVQVSK-UHFFFAOYSA-N	CC(CCCC(CCCC(C)CC1CCCCC1)CCCC2CCCCC2)CCC(CC(C)CC3CCCCC3)C4CCC(C)C4	WAODTAHHIDCUOY-UHFFFAOYSA-N	C(COCC(OCCc1ccccc1)C2OCC=C2)NC=C(CCOCCc3ccccc3)SSCc4ccccc4	CTSRHJFCRUESMV-UHFFFAOYSA-N	C(CCC=C(CCCCCc1ccccc1)CCCc2ccccc2)CCC(CCCc3ccccc3)C4CCC=C4	WSSVDTDJQUIXAN-UHFFFAOYSA-N	C(CCCC(CCCC1CCCCC1)C2CCCC2)CCC(CCCCCC3CCCCC3)CCCC4CCCCC4
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CCCCCC\C(=N/O)\c1cc(OC)c2C(=O)C=CC(=O)c2c1OC	FKBSRNIEUJMJJY-DEDYPNTBSA-N	CRFJLFXKAHGPQH-UHFFFAOYSA-N	CCCCCCC(=N)c1cc(OC)c2C(=O)C=CC(=O)c2c1	FNQCKUWWRSJGFH-UHFFFAOYSA-N	CCCCCCC(=C)c1cc(CC)c2C(=C)C=CC(=C)c2c1	WXZXVCOHNBOIAB-UHFFFAOYSA-N	CCCCCCC(C)C1CC(CC)C2C(C)CCC(C)C2C1	FRASJONUBLZVQX-UHFFFAOYSA-N	O=C1C=CC(=O)c2ccccc12	JXKQLTYPWVSUEQ-UHFFFAOYSA-N	C=C1C=CC(=C)c2ccccc12	POHSTLAFRROMOQ-UHFFFAOYSA-N	CC1CCC(C)C2CCCCC12	FUPIVZHYVSCYLX-UHFFFAOYSA-N	C1C=CCc2ccccc12	FUPIVZHYVSCYLX-UHFFFAOYSA-N	C1C=CCc2ccccc12	NNBZCPXTIHJBJL-UHFFFAOYSA-N	C1CCC2CCCCC2C1
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COc1ccc(cc1)C(=O)n2nc(C)c3nnc4cc(Cl)c(F)cc4c23	ITDSGUVCDWZQBV-UHFFFAOYSA-N	KSGWAAKZLSCZLF-UHFFFAOYSA-N	COc1ccc(cc1)C(=O)n2nc(C)c3nnc4ccccc4c23	DKTYQPBXVWOITN-UHFFFAOYSA-N	CCc1ccc(cc1)C(=C)C2C=C(C)c3ccc4ccccc4c23	GESQFHGMGLJCTK-UHFFFAOYSA-N	CCC1CCC(CC1)C(C)C2CC(C)C3CCC4CCCCC4C23	LPAIMHQXJKPUCI-UHFFFAOYSA-N	O=C(c1ccccc1)n2ncc3nnc4ccccc4c23	HWCKJDMCSGDCKU-UHFFFAOYSA-N	C=C(C1C=Cc2ccc3ccccc3c12)c4ccccc4	WDRFGKUKHRCDTH-UHFFFAOYSA-N	CC(C1CCCCC1)C2CCC3CCC4CCCCC4C23	IMJBBRGJGKJNMH-UHFFFAOYSA-N	C(c1ccccc1)n2ncc3nnc4ccccc4c23	DVYONKRQAPXYPK-UHFFFAOYSA-N	C(C1C=Cc2ccc3ccccc3c12)c4ccccc4	WENBYSUDTHMWFF-UHFFFAOYSA-N	C(C1CCCCC1)C2CCC3CCC4CCCCC4C23
Clc1ccc(cc1)c2oc(CN3N=C(C(=NC3=O)c4ccccc4)c5ccccc5)nn2	QUBLCFFIKVKFME-UHFFFAOYSA-N	DCYNZCSRFFGEDU-UHFFFAOYSA-N	O=C1N=C(C(=NN1Cc2oc(nn2)c3ccccc3)c4ccccc4)c5ccccc5	FRMGJXGRHOTMTM-UHFFFAOYSA-N	C=C1C=C(C(=CC1CC2=CC=C(C2)c3ccccc3)c4ccccc4)c5ccccc5	YEBNKRLQLLRGOW-UHFFFAOYSA-N	CC1CC(C2CCCCC2)C(CC1CC3CCC(C3)C4CCCCC4)C5CCCCC5	DCYNZCSRFFGEDU-UHFFFAOYSA-N	O=C1N=C(C(=NN1Cc2oc(nn2)c3ccccc3)c4ccccc4)c5ccccc5	FRMGJXGRHOTMTM-UHFFFAOYSA-N	C=C1C=C(C(=CC1CC2=CC=C(C2)c3ccccc3)c4ccccc4)c5ccccc5	YEBNKRLQLLRGOW-UHFFFAOYSA-N	CC1CC(C2CCCCC2)C(CC1CC3CCC(C3)C4CCCCC4)C5CCCCC5	SLGOBPIDHLJBMQ-UHFFFAOYSA-N	C(N1CN=C(C(=N1)c2ccccc2)c3ccccc3)c4oc(nn4)c5ccccc5	WFXRWDKTFAGLDV-UHFFFAOYSA-N	C(C1CC=C(C(=C1)c2ccccc2)c3ccccc3)C4=CC=C(C4)c5ccccc5	UUMNAJCITFLIEQ-UHFFFAOYSA-N	C(C1CCC(C1)C2CCCCC2)C3CCC(C4CCCCC4)C(C3)C5CCCCC5
CC(C)Cc1ccc(cc1)C(C)C(=O)SC[C@@H](NC(=O)C)C(=O)OCCCCO[N+](=O)[O-]	FZBZHBRDXLXIOW-OTOKDRCRSA-N	ONMHHYVGIJATSU-UHFFFAOYSA-N	CCCCOC(=O)CCSC(=O)Cc1ccc(CCC)cc1	BSJDQKGGYBHQCT-UHFFFAOYSA-N	CCCCCC(=C)CCCC(=C)Cc1ccc(CCC)cc1	PKVCBUIEJJQMHX-UHFFFAOYSA-N	CCCCCC(C)CCCC(C)CC1CCC(CCC)CC1	UHOVQNZJYSORNB-UHFFFAOYSA-N	c1ccccc1	UHOVQNZJYSORNB-UHFFFAOYSA-N	c1ccccc1	XDTMQSROBMDMFD-UHFFFAOYSA-N	C1CCCCC1	UHOVQNZJYSORNB-UHFFFAOYSA-N	c1ccccc1	UHOVQNZJYSORNB-UHFFFAOYSA-N	c1ccccc1	XDTMQSROBMDMFD-UHFFFAOYSA-N	C1CCCCC1
COc1ccc(cc1)c2oc(CN3N=C(C(=NC3=O)c4ccccc4)c5ccccc5)nn2	BLDMCAJCUTWQRV-UHFFFAOYSA-N	BLDMCAJCUTWQRV-UHFFFAOYSA-N	COc1ccc(cc1)c2oc(CN3N=C(C(=NC3=O)c4ccccc4)c5ccccc5)nn2	DWFKUBHEMDNFDQ-UHFFFAOYSA-N	CCc1ccc(cc1)C2=CC=C(CC3C=C(C(=CC3=C)c4ccccc4)c5ccccc5)C2	WQFDXRCJPPRYQL-UHFFFAOYSA-N	CCC1CCC(CC1)C2CCC(CC3CC(C4CCCCC4)C(CC3C)C5CCCCC5)C2	DCYNZCSRFFGEDU-UHFFFAOYSA-N	O=C1N=C(C(=NN1Cc2oc(nn2)c3ccccc3)c4ccccc4)c5ccccc5	FRMGJXGRHOTMTM-UHFFFAOYSA-N	C=C1C=C(C(=CC1CC2=CC=C(C2)c3ccccc3)c4ccccc4)c5ccccc5	YEBNKRLQLLRGOW-UHFFFAOYSA-N	CC1CC(C2CCCCC2)C(CC1CC3CCC(C3)C4CCCCC4)C5CCCCC5	SLGOBPIDHLJBMQ-UHFFFAOYSA-N	C(N1CN=C(C(=N1)c2ccccc2)c3ccccc3)c4oc(nn4)c5ccccc5	WFXRWDKTFAGLDV-UHFFFAOYSA-N	C(C1CC=C(C(=C1)c2ccccc2)c3ccccc3)C4=CC=C(C4)c5ccccc5	UUMNAJCITFLIEQ-UHFFFAOYSA-N	C(C1CCC(C1)C2CCCCC2)C3CCC(C4CCCCC4)C(C3)C5CCCCC5
CS(=O)(=O)c1ccc(cc1)C2Nc3ccccc3C(=O)N2c4ccc(Cl)cc4	PXLREINNKDOJGV-UHFFFAOYSA-N	BDAZOZSTYHYPBO-UHFFFAOYSA-N	CS(=O)(=O)c1ccc(cc1)C2Nc3ccccc3C(=O)N2c4ccccc4	MPGNILFVTMZOGS-UHFFFAOYSA-N	C[C](=C)(=C)c1ccc(cc1)C2Cc3ccccc3C(=C)C2c4ccccc4	QRZSCDDTUMIBRD-UHFFFAOYSA-N	CC1C2CCCCC2CC(C3CCC(CC3)C(C)(C)C)C1C4CCCCC4	ZWCLIAUJIDVIDD-UHFFFAOYSA-N	O=C1N(C(Nc2ccccc12)c3ccccc3)c4ccccc4	LBEHEIWTKPPCFY-UHFFFAOYSA-N	C=C1C(C(Cc2ccccc12)c3ccccc3)c4ccccc4	LFWIOYJGZMAFKD-UHFFFAOYSA-N	CC1C2CCCCC2CC(C3CCCCC3)C1C4CCCCC4	WCSUAJLKMWYHIV-UHFFFAOYSA-N	C1N(C(Nc2ccccc12)c3ccccc3)c4ccccc4	IBWJMJTYJRZECS-UHFFFAOYSA-N	C1C(C(Cc2ccccc12)c3ccccc3)c4ccccc4	ZSPLAXJBIFTUGP-UHFFFAOYSA-N	C1CCC(CC1)C2CC3CCCCC3CC2C4CCCCC4
[11CH3]S(=O)(=O)c1ccc(cc1)c2noc(c2c3ccccc3)C(F)(F)F	KKBWWVXRKULXHF-BJUDXGSMSA-N	KROUGDLXJMNHCE-JVVVGQRLSA-N	[11CH3]S(=O)(=O)c1ccc(cc1)c2noc(C)c2c3ccccc3	JLWKXGZOYGCXQU-UHFFFAOYSA-N	CC1=C(C(=CC1)c2ccc(cc2)[C](=C)(=C)C)c3ccccc3	JTDNMPNJCRKXGE-UHFFFAOYSA-N	CC1CCC(C2CCC(CC2)C(C)(C)C)C1C3CCCCC3	UAVZKRLWYOSHHP-UHFFFAOYSA-N	o1cc(c2ccccc2)c(n1)c3ccccc3	JZROHVYWVWGBBX-UHFFFAOYSA-N	C1C=C(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	UAVZKRLWYOSHHP-UHFFFAOYSA-N	o1cc(c2ccccc2)c(n1)c3ccccc3	JZROHVYWVWGBBX-UHFFFAOYSA-N	C1C=C(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
[O-][N+](=O)c1ccc(cc1)c2oc(CN3N=C(C(=NC3=O)c4ccccc4)c5ccccc5)nn2	LCPYSDJBXZLZLO-UHFFFAOYSA-N	DCYNZCSRFFGEDU-UHFFFAOYSA-N	O=C1N=C(C(=NN1Cc2oc(nn2)c3ccccc3)c4ccccc4)c5ccccc5	FRMGJXGRHOTMTM-UHFFFAOYSA-N	C=C1C=C(C(=CC1CC2=CC=C(C2)c3ccccc3)c4ccccc4)c5ccccc5	YEBNKRLQLLRGOW-UHFFFAOYSA-N	CC1CC(C2CCCCC2)C(CC1CC3CCC(C3)C4CCCCC4)C5CCCCC5	DCYNZCSRFFGEDU-UHFFFAOYSA-N	O=C1N=C(C(=NN1Cc2oc(nn2)c3ccccc3)c4ccccc4)c5ccccc5	FRMGJXGRHOTMTM-UHFFFAOYSA-N	C=C1C=C(C(=CC1CC2=CC=C(C2)c3ccccc3)c4ccccc4)c5ccccc5	YEBNKRLQLLRGOW-UHFFFAOYSA-N	CC1CC(C2CCCCC2)C(CC1CC3CCC(C3)C4CCCCC4)C5CCCCC5	SLGOBPIDHLJBMQ-UHFFFAOYSA-N	C(N1CN=C(C(=N1)c2ccccc2)c3ccccc3)c4oc(nn4)c5ccccc5	WFXRWDKTFAGLDV-UHFFFAOYSA-N	C(C1CC=C(C(=C1)c2ccccc2)c3ccccc3)C4=CC=C(C4)c5ccccc5	UUMNAJCITFLIEQ-UHFFFAOYSA-N	C(C1CCC(C1)C2CCCCC2)C3CCC(C4CCCCC4)C(C3)C5CCCCC5
CS(=O)(=O)c1ccc(cc1)C2CC(=NN2c3ccc(F)cc3F)C(F)(F)F	NUUXNKLZACNVSR-UHFFFAOYSA-N	VMRBITBSIDDKSD-UHFFFAOYSA-N	CC1=NN(C(C1)c2ccc(cc2)S(=O)(=O)C)c3ccccc3	NSPCUKZADUHITJ-UHFFFAOYSA-N	CC1=CC(C(C1)c2ccc(cc2)[C](=C)(=C)C)c3ccccc3	XFTBKNXYSSNWEK-UHFFFAOYSA-N	CC1CC(C2CCCCC2)C(C1)C3CCC(CC3)C(C)(C)C	OQYNUZDJQMOTFA-UHFFFAOYSA-N	C1C=NN(C1c2ccccc2)c3ccccc3	RTBDRLYNZOJMMV-UHFFFAOYSA-N	C1C=CC(C1c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	OQYNUZDJQMOTFA-UHFFFAOYSA-N	C1C=NN(C1c2ccccc2)c3ccccc3	RTBDRLYNZOJMMV-UHFFFAOYSA-N	C1C=CC(C1c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
COc1ccc(cc1)C2=NNC(C2)c3ccc4c(c3)c5ccccc5n4C	WOCZLCAGLJMDAP-UHFFFAOYSA-N	WOCZLCAGLJMDAP-UHFFFAOYSA-N	COc1ccc(cc1)C2=NNC(C2)c3ccc4c(c3)c5ccccc5n4C	UMYNDFKGMSZPMN-UHFFFAOYSA-N	CCc1ccc(cc1)C2=CCC(C2)c3ccc4C(C)c5ccccc5c4c3	ORQYUZVLLKGIJW-UHFFFAOYSA-N	CCC1CCC(CC1)C2CCC(C2)C3CCC4C(C)C5CCCCC5C4C3	JPMNWPVKVGHTSV-UHFFFAOYSA-N	C1C(NN=C1c2ccccc2)c3ccc4[nH]c5ccccc5c4c3	GDHAOLKXRVTPCO-UHFFFAOYSA-N	C1C=C(CC1c2ccc3Cc4ccccc4c3c2)c5ccccc5	XDUFWCRZOVEEFV-UHFFFAOYSA-N	C1CCC(CC1)C2CCC(C2)C3CCC4CC5CCCCC5C4C3	JPMNWPVKVGHTSV-UHFFFAOYSA-N	C1C(NN=C1c2ccccc2)c3ccc4[nH]c5ccccc5c4c3	GDHAOLKXRVTPCO-UHFFFAOYSA-N	C1C=C(CC1c2ccc3Cc4ccccc4c3c2)c5ccccc5	XDUFWCRZOVEEFV-UHFFFAOYSA-N	C1CCC(CC1)C2CCC(C2)C3CCC4CC5CCCCC5C4C3
C[C@H]1[C@@H](O)C[C@H]2[C@@H]1[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C2C(=O)O	JNNGEAWILNVFFD-CDJYTOATSA-N	JZFFRHVNWMXHMD-ZSAUSMIDSA-N	C[C@@H]1CCC[C@H](O[C@@H]2OC=C(C)[C@H]3CCC[C@@H]23)O1	LPRPHTADYXKQPG-XNJHUCFUSA-N	CC1CCCC(CC2CC=C(C)C3CCCC23)C1	LDIRLINUIPBOJT-UHFFFAOYSA-N	CC1CCCC(CC2CCC(C)C3CCCC23)C1	HRYKYSJNCLNTAT-NDBYEHHHSA-N	C1CC[C@H](O[C@@H]2OC=C[C@H]3CCC[C@@H]23)OC1	QHJOPVQZUHABSN-UHFFFAOYSA-N	C(C1CCCCC1)C2CC=CC3CCCC23	APTYPVYSYORIES-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCC3CCCC23	HRYKYSJNCLNTAT-NDBYEHHHSA-N	C1CC[C@H](O[C@@H]2OC=C[C@H]3CCC[C@@H]23)OC1	QHJOPVQZUHABSN-UHFFFAOYSA-N	C(C1CCCCC1)C2CC=CC3CCCC23	APTYPVYSYORIES-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCC3CCCC23
NS(=O)(=O)c1ccc(cc1)c2c(CO[N+](=O)[O-])onc2c3ccccc3	OILIHSBVKGKIBV-UHFFFAOYSA-N	ZXIRUKJWLADSJS-UHFFFAOYSA-N	Cc1onc(c2ccccc2)c1c3ccccc3	JZSPDNUNYOINOM-UHFFFAOYSA-N	CC1=C(C(=CC1)c2ccccc2)c3ccccc3	FGISMPWADDIBOF-UHFFFAOYSA-N	CC1CCC(C2CCCCC2)C1C3CCCCC3	UAVZKRLWYOSHHP-UHFFFAOYSA-N	o1cc(c2ccccc2)c(n1)c3ccccc3	JZROHVYWVWGBBX-UHFFFAOYSA-N	C1C=C(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	UAVZKRLWYOSHHP-UHFFFAOYSA-N	o1cc(c2ccccc2)c(n1)c3ccccc3	JZROHVYWVWGBBX-UHFFFAOYSA-N	C1C=C(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
CC(NO)c1ccc(cc1)N2CCOCC2	PKYANAVEEIVCJF-UHFFFAOYSA-N	DBNRBEJKPXCZCT-UHFFFAOYSA-N	CCc1ccc(cc1)N2CCOCC2	NXDYRIDLOUSORJ-UHFFFAOYSA-N	CCc1ccc(cc1)C2CCCCC2	GOTAHZOPIWLFOQ-UHFFFAOYSA-N	CCC1CCC(CC1)C2CCCCC2	FHQRDEDZJIFJAL-UHFFFAOYSA-N	C1CN(CCO1)c2ccccc2	IGARGHRYKHJQSM-UHFFFAOYSA-N	C1CCC(CC1)c2ccccc2	WVIIMZNLDWSIRH-UHFFFAOYSA-N	C1CCC(CC1)C2CCCCC2	FHQRDEDZJIFJAL-UHFFFAOYSA-N	C1CN(CCO1)c2ccccc2	IGARGHRYKHJQSM-UHFFFAOYSA-N	C1CCC(CC1)c2ccccc2	WVIIMZNLDWSIRH-UHFFFAOYSA-N	C1CCC(CC1)C2CCCCC2
Cc1c(CCOCCO[N+](=O)[O-])cc(c2ccc(cc2)S(=O)(=O)C)n1c3ccccc3	IIFFGAKIUNZWTM-UHFFFAOYSA-N	BZOFVJVLNJVTIC-UHFFFAOYSA-N	CCOCCc1cc(c2ccc(cc2)S(=O)(=O)C)n(c1)c3ccccc3	DFALIHCIQIUGJK-UHFFFAOYSA-N	CCCCCC1=CC(C(=C1)c2ccc(cc2)[C](=C)(=C)C)c3ccccc3	UUUPBPMDQOZUPF-UHFFFAOYSA-N	CCCCCC1CC(C2CCCCC2)C(C1)C3CCC(CC3)C(C)(C)C	ZZDIPNSMKJPHTR-UHFFFAOYSA-N	c1ccc(cc1)c2cccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	ZZDIPNSMKJPHTR-UHFFFAOYSA-N	c1ccc(cc1)c2cccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
[O-][N+](=O)c1ccc(cc1)c2oc(Cn3c(CSc4ncccn4)nc5ccccc35)nn2	MIOVEVWMSUTQRW-UHFFFAOYSA-N	QJBUUEBJNDPKTR-UHFFFAOYSA-N	C(Sc1ncccn1)c2nc3ccccc3n2Cc4oc(nn4)c5ccccc5	LSNSFKIJTYFMSY-UHFFFAOYSA-N	C(Cc1ccccc1)C2=Cc3ccccc3C2CC4=CC=C(C4)c5ccccc5	WLDLTWHQXPQRGO-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1CC3CCC(C3)C4CCCCC4)C5CCCCC5	QJBUUEBJNDPKTR-UHFFFAOYSA-N	C(Sc1ncccn1)c2nc3ccccc3n2Cc4oc(nn4)c5ccccc5	LSNSFKIJTYFMSY-UHFFFAOYSA-N	C(Cc1ccccc1)C2=Cc3ccccc3C2CC4=CC=C(C4)c5ccccc5	WLDLTWHQXPQRGO-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1CC3CCC(C3)C4CCCCC4)C5CCCCC5	QJBUUEBJNDPKTR-UHFFFAOYSA-N	C(Sc1ncccn1)c2nc3ccccc3n2Cc4oc(nn4)c5ccccc5	LSNSFKIJTYFMSY-UHFFFAOYSA-N	C(Cc1ccccc1)C2=Cc3ccccc3C2CC4=CC=C(C4)c5ccccc5	WLDLTWHQXPQRGO-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1CC3CCC(C3)C4CCCCC4)C5CCCCC5
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Nc1ccc(O)c(c1)c2nc3ccccc3[nH]2	JKSYIKAAFVWVRO-UHFFFAOYSA-N	DWYHDSLIWMUSOO-UHFFFAOYSA-N	c1ccc(cc1)c2nc3ccccc3[nH]2	BSBXLZYWGGAVHD-UHFFFAOYSA-N	C1C(=Cc2ccccc12)c3ccccc3	JXASEBKWWMNGBY-UHFFFAOYSA-N	C1CCC(CC1)C2CC3CCCCC3C2	DWYHDSLIWMUSOO-UHFFFAOYSA-N	c1ccc(cc1)c2nc3ccccc3[nH]2	BSBXLZYWGGAVHD-UHFFFAOYSA-N	C1C(=Cc2ccccc12)c3ccccc3	JXASEBKWWMNGBY-UHFFFAOYSA-N	C1CCC(CC1)C2CC3CCCCC3C2	DWYHDSLIWMUSOO-UHFFFAOYSA-N	c1ccc(cc1)c2nc3ccccc3[nH]2	BSBXLZYWGGAVHD-UHFFFAOYSA-N	C1C(=Cc2ccccc12)c3ccccc3	JXASEBKWWMNGBY-UHFFFAOYSA-N	C1CCC(CC1)C2CC3CCCCC3C2
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CC(C)Cc1ccc(cc1)C(C)c2nc3ccc(cc3[nH]2)C(=O)c4ccccc4	GMTQCEKMXRMKEV-UHFFFAOYSA-N	ZGIQAFAATBUUGQ-UHFFFAOYSA-N	CCCc1ccc(cc1)C(C)c2nc3ccc(cc3[nH]2)C(=O)c4ccccc4	MARBUCGQTGXPSE-UHFFFAOYSA-N	CCCc1ccc(cc1)C(C)C2=Cc3ccc(cc3C2)C(=C)c4ccccc4	ANECJEUJNLCNFW-UHFFFAOYSA-N	CCCC1CCC(CC1)C(C)C2CC3CCC(CC3C2)C(C)C4CCCCC4	RAADBMGCFGLPBA-UHFFFAOYSA-N	O=C(c1ccccc1)c2ccc3nc(Cc4ccccc4)[nH]c3c2	XOTABTXIHPKJKC-UHFFFAOYSA-N	C=C(c1ccccc1)c2ccc3C=C(Cc4ccccc4)Cc3c2	SQOFRCRBTVKCLS-UHFFFAOYSA-N	CC(C1CCCCC1)C2CCC3CC(CC4CCCCC4)CC3C2	FXVMSKNCNFVBBG-UHFFFAOYSA-N	C(c1ccccc1)c2ccc3nc(Cc4ccccc4)[nH]c3c2	YTRIGZBCSGSINM-UHFFFAOYSA-N	C(C1=Cc2ccc(Cc3ccccc3)cc2C1)c4ccccc4	DJTIPUDELKFPPT-UHFFFAOYSA-N	C(C1CCCCC1)C2CCC3CC(CC4CCCCC4)CC3C2
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CCCC(=O)NS(=O)(=O)c1ccc(cc1)n2nc(cc2c3ccc(C)cc3)C(F)(F)F	BQHUSCLVOWMCKW-UHFFFAOYSA-N	BJJFELDKAATARH-UHFFFAOYSA-N	CCCC(=O)NS(=O)(=O)c1ccc(cc1)n2nccc2c3ccc(C)cc3	DHCPIXCKBDOXGF-UHFFFAOYSA-N	CCCC(=C)C[C](=C)(=C)c1ccc(cc1)C2C=CC=C2c3ccc(C)cc3	UMUCGBRRWGPXMU-UHFFFAOYSA-N	CCCC(C)CC(C)(C)C1CCC(CC1)C2CCCC2C3CCC(C)CC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
COc1ccc2c(c1)c(CC(=O)OCc3ccc(OC(=O)OCCC(C)(C)C)cc3)c(C)n2C(=O)c4ccc(Cl)cc4	DHVSCTXXPREERV-UHFFFAOYSA-N	OBXQSNGVOOPBMI-UHFFFAOYSA-N	CCCCOC(=O)Oc1ccc(COC(=O)Cc2cn(C(=O)c3ccccc3)c4ccc(OC)cc24)cc1	XUVTXHHYUJFKCY-UHFFFAOYSA-N	CCCCCC(=C)Cc1ccc(CCC(=C)CC2=CC(C(=C)c3ccccc3)c4ccc(CC)cc24)cc1	MDSIFGIQGNJKMQ-UHFFFAOYSA-N	CCCCCC(C)CC1CCC(CCC(C)CC2CC(C(C)C3CCCCC3)C4CCC(CC)CC24)CC1	WTYUVQPJAXFAGY-UHFFFAOYSA-N	O=C(Cc1cn(C(=O)c2ccccc2)c3ccccc13)OCc4ccccc4	KBXHVVAOPIUHHL-UHFFFAOYSA-N	C=C(CCc1ccccc1)CC2=CC(C(=C)c3ccccc3)c4ccccc24	CUAJLVLOEBGUPM-UHFFFAOYSA-N	CC(CCC1CCCCC1)CC2CC(C(C)C3CCCCC3)C4CCCCC24	SBJXYJZKAQQQDQ-UHFFFAOYSA-N	C(Cc1cn(Cc2ccccc2)c3ccccc13)OCc4ccccc4	JHEURTZTLQQPLF-UHFFFAOYSA-N	C(CCc1ccccc1)CC2=CC(Cc3ccccc3)c4ccccc24	VKDZINBUWDYXIM-UHFFFAOYSA-N	C(CCC1CC(CC2CCCCC2)C3CCCCC13)CC4CCCCC4
Nc1ccc(O)c(c1)C(=O)Nc2nc3ccc(cc3[nH]2)[N+](=O)[O-]	NMGQLUJTRQLFMY-UHFFFAOYSA-N	LYLQJTSHZYGWBO-UHFFFAOYSA-N	O=C(Nc1nc2ccccc2[nH]1)c3ccccc3	ISMZCDXXXNYJPD-UHFFFAOYSA-N	C=C(CC1=Cc2ccccc2C1)c3ccccc3	CJIZEXITJDLHSJ-UHFFFAOYSA-N	CC(CC1CC2CCCCC2C1)C3CCCCC3	LYLQJTSHZYGWBO-UHFFFAOYSA-N	O=C(Nc1nc2ccccc2[nH]1)c3ccccc3	ISMZCDXXXNYJPD-UHFFFAOYSA-N	C=C(CC1=Cc2ccccc2C1)c3ccccc3	CJIZEXITJDLHSJ-UHFFFAOYSA-N	CC(CC1CC2CCCCC2C1)C3CCCCC3	FXMPPQGQNSTUGE-UHFFFAOYSA-N	C(Nc1nc2ccccc2[nH]1)c3ccccc3	METAXSYVQINTRD-UHFFFAOYSA-N	C(Cc1ccccc1)C2=Cc3ccccc3C2	PIBNZLSBKHNGBG-UHFFFAOYSA-N	C(CC1CC2CCCCC2C1)C3CCCCC3
Brc1ccc2[nH]cc(\C=C\C(=O)c3ccc(cc3)C#N)c2c1	QYEFQRPRWKTQGT-VMPITWQZSA-N	XBROCKGLAZJKJG-ZHACJKMWSA-N	Cc1ccc(cc1)C(=O)\C=C\c2c[nH]c3ccccc23	BQZRTEBBAUBQNB-FMIVXFBMSA-N	Cc1ccc(cc1)C(=C)\C=C\C2=CCc3ccccc23	SMIJJEGVNIIYRU-UHFFFAOYSA-N	CC(CCC1CCC2CCCCC12)C3CCC(C)CC3	XVTDCPBGCCPEBA-ZHACJKMWSA-N	O=C(\C=C\c1c[nH]c2ccccc12)c3ccccc3	XSAKDSRHBQYQGC-VAWYXSNFSA-N	C=C(\C=C\C1=CCc2ccccc12)c3ccccc3	IDVQLLGKXZQTCX-UHFFFAOYSA-N	CC(CCC1CCC2CCCCC12)C3CCCCC3	BKOFLNGGBOMFJW-UXBLZVDNSA-N	C(\C=C\c1c[nH]c2ccccc12)c3ccccc3	INAGMYMVBQSRPM-IZZDOVSWSA-N	C(\C=C\C1=CCc2ccccc12)c3ccccc3	QWRFHIQBNHOYOQ-UHFFFAOYSA-N	C(CC1CCCCC1)CC2CCC3CCCCC23
CCC(=O)NS(=O)(=O)c1ccc(cc1)n2nc(cc2c3ccc(C)cc3)C(F)(F)F	XBRFSAUQBGTLPG-UHFFFAOYSA-N	JOZQTFGDTLUYGC-UHFFFAOYSA-N	CCC(=O)NS(=O)(=O)c1ccc(cc1)n2nccc2c3ccc(C)cc3	YVIZMLARPFKJHH-UHFFFAOYSA-N	CCC(=C)C[C](=C)(=C)c1ccc(cc1)C2C=CC=C2c3ccc(C)cc3	SLCQYGIPTVLPOC-UHFFFAOYSA-N	CCC(C)CC(C)(C)C1CCC(CC1)C2CCCC2C3CCC(C)CC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	IDCXLYCLPHRSAZ-UHFFFAOYSA-N	c1ccc(cc1)c2ccnn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
[2H]C([2H])([2H])c1cc2C=C([C@H](Oc2c(c1)C([2H])([2H])[2H])C(F)(F)F)C(=O)O	AXLIJRCKRUPBPQ-FMQCZQQZSA-N	SIOGASNAGPHUTG-SECBINFHSA-N	C[C@H]1Oc2ccc(C)cc2C=C1	YISFDKDYJGOLIM-SNVBAGLBSA-N	CC1Cc2ccc(C)cc2C=C1	XNOHNIPVHGINQP-UHFFFAOYSA-N	CC1CCC2CC(C)CCC2C1	KYNSBQPICQTCGU-UHFFFAOYSA-N	C1Oc2ccccc2C=C1	KEIFWROAQVVDBN-UHFFFAOYSA-N	C1Cc2ccccc2C=C1	NNBZCPXTIHJBJL-UHFFFAOYSA-N	C1CCC2CCCCC2C1	KYNSBQPICQTCGU-UHFFFAOYSA-N	C1Oc2ccccc2C=C1	KEIFWROAQVVDBN-UHFFFAOYSA-N	C1Cc2ccccc2C=C1	NNBZCPXTIHJBJL-UHFFFAOYSA-N	C1CCC2CCCCC2C1
COc1cc(\C=C\c2onc(\C=C\c3ccc(O)c(OC)c3)c2)ccc1O	MRBBFOWSPXHYQT-FCXRPNKRSA-N	XEOWTMCXRYARQJ-WGDLNXRISA-N	COc1cccc(\C=C\c2onc(\C=C\c3cccc(OC)c3)c2)c1	YOYDLJOETBCREU-PHEQNACWSA-N	CCc1cccc(\C=C\C2=CC(=CC2)\C=C\c3cccc(CC)c3)c1	WKWILPRQRANEDL-UHFFFAOYSA-N	CCC1CCCC(CCC2CCC(CCC3CCCC(CC)C3)C2)C1	ZHJGWSNJLOHKAP-PHEQNACWSA-N	o1nc(\C=C\c2ccccc2)cc1\C=C\c3ccccc3	SPQRIVLUEJBKHW-PHEQNACWSA-N	C1C=C(\C=C\c2ccccc2)C=C1\C=C\c3ccccc3	WPNBHKAJGDDTEN-UHFFFAOYSA-N	C(CC1CCC(CCC2CCCCC2)C1)C3CCCCC3	ZHJGWSNJLOHKAP-PHEQNACWSA-N	o1nc(\C=C\c2ccccc2)cc1\C=C\c3ccccc3	SPQRIVLUEJBKHW-PHEQNACWSA-N	C1C=C(\C=C\c2ccccc2)C=C1\C=C\c3ccccc3	WPNBHKAJGDDTEN-UHFFFAOYSA-N	C(CC1CCC(CCC2CCCCC2)C1)C3CCCCC3
COc1ccc(cc1)c2cc(nn2CC(=O)Nc3ccc(cc3)S(=O)(=O)N)c4ccccc4	QNTMPOMWOURVRJ-UHFFFAOYSA-N	ATINCGYLUJPRSA-UHFFFAOYSA-N	COc1ccc(cc1)c2cc(nn2CC(=O)Nc3ccccc3)c4ccccc4	CQCQYBOJQIHDRJ-UHFFFAOYSA-N	CCc1ccc(cc1)C2=CC(=CC2CC(=C)Cc3ccccc3)c4ccccc4	FRTKHIUNZWHZLC-UHFFFAOYSA-N	CCC1CCC(CC1)C2CC(CC2CC(C)CC3CCCCC3)C4CCCCC4	YWSSWZLPZZKZFD-UHFFFAOYSA-N	O=C(Cn1nc(cc1c2ccccc2)c3ccccc3)Nc4ccccc4	WVKJHWKHJZHLGW-UHFFFAOYSA-N	C=C(CC1C=C(C=C1c2ccccc2)c3ccccc3)Cc4ccccc4	QETWXWFBYWOQJP-UHFFFAOYSA-N	CC(CC1CCCCC1)CC2CC(CC2C3CCCCC3)C4CCCCC4	WDAQVXITAIPVGB-UHFFFAOYSA-N	C(Cn1nc(cc1c2ccccc2)c3ccccc3)Nc4ccccc4	UDSVSFQEUHFLRG-UHFFFAOYSA-N	C(CC1C=C(C=C1c2ccccc2)c3ccccc3)Cc4ccccc4	SNPRYGLUUYHHCL-UHFFFAOYSA-N	C(CC1CCCCC1)CC2CC(CC2C3CCCCC3)C4CCCCC4
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FC(F)(F)S(=O)(=O)Nc1ccncc1Nc2ccc(Cl)cc2	BJSHRSBHYAVRGG-UHFFFAOYSA-N	QOJPQADRTOBBQV-UHFFFAOYSA-N	CS(=O)(=O)Nc1ccncc1Nc2ccccc2	GKNBLKXNCCYGSK-UHFFFAOYSA-N	C[C](=C)(=C)Cc1ccccc1Cc2ccccc2	RETPDFYORYWNLG-UHFFFAOYSA-N	CC(C)(C)CC1CCCCC1CC2CCCCC2	JNYYORRROUFDBG-UHFFFAOYSA-N	N(c1ccccc1)c2cccnc2	CZZYITDELCSZES-UHFFFAOYSA-N	C(c1ccccc1)c2ccccc2	XXKOQQBKBHUATC-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCCC2	JNYYORRROUFDBG-UHFFFAOYSA-N	N(c1ccccc1)c2cccnc2	CZZYITDELCSZES-UHFFFAOYSA-N	C(c1ccccc1)c2ccccc2	XXKOQQBKBHUATC-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCCC2
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CS(=O)(=O)c1ccc(cc1)c2nc([18F])cc(NCc3cccs3)n2	FAIRWSWNVPKWCX-SJPDSGJFSA-N	GMZASHSKZUFXGX-UHFFFAOYSA-N	CS(=O)(=O)c1ccc(cc1)c2nccc(NCc3cccs3)n2	UKPOYYLPDWSODT-UHFFFAOYSA-N	C[C](=C)(=C)c1ccc(cc1)c2cccc(CCC3=CC=CC3)c2	FRMGTKLPKNJHFL-UHFFFAOYSA-N	CC(C)(C)C1CCC(CC1)C2CCCC(CCC3CCCC3)C2	ORGLOBLMKFEHGG-UHFFFAOYSA-N	C(Nc1ccnc(n1)c2ccccc2)c3cccs3	SWWYVYYKQNHCJB-UHFFFAOYSA-N	C(Cc1cccc(c1)c2ccccc2)C3=CC=CC3	QVVQIAZGSQLDRG-UHFFFAOYSA-N	C(CC1CCCC(C1)C2CCCCC2)C3CCCC3	ORGLOBLMKFEHGG-UHFFFAOYSA-N	C(Nc1ccnc(n1)c2ccccc2)c3cccs3	SWWYVYYKQNHCJB-UHFFFAOYSA-N	C(Cc1cccc(c1)c2ccccc2)C3=CC=CC3	QVVQIAZGSQLDRG-UHFFFAOYSA-N	C(CC1CCCC(C1)C2CCCCC2)C3CCCC3
COc1ccc2c(c1)c(CC(=O)O)c(C)n2Cc3ccc([123I])cc3	SYJZPSKFBMYMJX-BMILMZPDSA-N	RTHJEUBJEAYSTA-UHFFFAOYSA-N	CCc1cn(Cc2ccccc2)c3ccc(OC)cc13	UPVCUJDLYRSOQE-UHFFFAOYSA-N	CCC1=CC(Cc2ccccc2)c3ccc(CC)cc13	JBJDWPPMFQVLBF-UHFFFAOYSA-N	CCC1CCC2C(CC3CCCCC3)CC(CC)C2C1	NJZQOCCEDXRQJM-UHFFFAOYSA-N	C(c1ccccc1)n2ccc3ccccc23	NBHBNYRLTADHQY-UHFFFAOYSA-N	C(C1C=Cc2ccccc12)c3ccccc3	YFVAAXAVNYXVIE-UHFFFAOYSA-N	C(C1CCCCC1)C2CCC3CCCCC23	NJZQOCCEDXRQJM-UHFFFAOYSA-N	C(c1ccccc1)n2ccc3ccccc23	NBHBNYRLTADHQY-UHFFFAOYSA-N	C(C1C=Cc2ccccc12)c3ccccc3	YFVAAXAVNYXVIE-UHFFFAOYSA-N	C(C1CCCCC1)C2CCC3CCCCC23
C[C@@]1(CCCCC(=O)O)CCC[C@]2(C)[C@@H]1CC[C@H]3C[C@](C)(CC=C23)C=C	IFIXXFKTBDCXOX-FNTNPWFNSA-N	AIDXVYZQRNGRMP-JSMKSKOISA-N	CCCCCC1CCCC2[C@@H]1CC[C@H]3CC(CC=C23)C=C	AIDXVYZQRNGRMP-JSMKSKOISA-N	CCCCCC1CCCC2C1CCC3CC(CC=C23)C=C	SWAIXSXDAKKVRR-UHFFFAOYSA-N	CCCCCC1CCCC2C1CCC3CC(CC)CCC23	RHZLFNIPVYCDSB-RJTITELWSA-N	C1CCC2[C@@H](C1)CC[C@H]3CCCC=C23	RHZLFNIPVYCDSB-UHFFFAOYSA-N	C1CCC2C(C1)CCC3CCCC=C23	GNMCGMFNBARSIY-UHFFFAOYSA-N	C1CCC2C(C1)CCC3CCCCC23	RHZLFNIPVYCDSB-RJTITELWSA-N	C1CCC2[C@@H](C1)CC[C@H]3CCCC=C23	RHZLFNIPVYCDSB-UHFFFAOYSA-N	C1CCC2C(C1)CCC3CCCC=C23	GNMCGMFNBARSIY-UHFFFAOYSA-N	C1CCC2C(C1)CCC3CCCCC23
[O-][N+](=O)c1ccc(cc1)C(=O)C=CC2=Cc3c(OC2)ccc4ccccc34	YFRJCYZCCDXDIT-UHFFFAOYSA-N	FMXOAYIDZYXWFZ-UHFFFAOYSA-N	O=C(C=CC1=Cc2c(OC1)ccc3ccccc23)c4ccccc4	YCSUTEGTKGKIKM-UHFFFAOYSA-N	C=C(C=CC1=Cc2c(CC1)ccc3ccccc23)c4ccccc4	WCZCAISYKPIXTF-UHFFFAOYSA-N	CC(CCC1CCC2CCC3CCCCC3C2C1)C4CCCCC4	FMXOAYIDZYXWFZ-UHFFFAOYSA-N	O=C(C=CC1=Cc2c(OC1)ccc3ccccc23)c4ccccc4	YCSUTEGTKGKIKM-UHFFFAOYSA-N	C=C(C=CC1=Cc2c(CC1)ccc3ccccc23)c4ccccc4	WCZCAISYKPIXTF-UHFFFAOYSA-N	CC(CCC1CCC2CCC3CCCCC3C2C1)C4CCCCC4	IBNOJXLFNMWWBZ-UHFFFAOYSA-N	C(C=CC1=Cc2c(OC1)ccc3ccccc23)c4ccccc4	LDFSIVKZVDZAOR-UHFFFAOYSA-N	C(C=CC1=Cc2c(CC1)ccc3ccccc23)c4ccccc4	YDEHNDMTYPLXLS-UHFFFAOYSA-N	C(CC1CCCCC1)CC2CCC3CCC4CCCCC4C3C2
CS(=O)(=O)c1ccc(cc1)c2cc(Br)sc2c3ccc(F)cc3	AJFTZWGGHJXZOB-UHFFFAOYSA-N	MSBASIVDVWMLRO-UHFFFAOYSA-N	CS(=O)(=O)c1ccc(cc1)c2ccsc2c3ccccc3	HOFKRFWVAXITAA-UHFFFAOYSA-N	C[C](=C)(=C)c1ccc(cc1)C2=C(CC=C2)c3ccccc3	YQMUFFMIOHTPMX-UHFFFAOYSA-N	CC(C)(C)C1CCC(CC1)C2CCCC2C3CCCCC3	RZFOAVRHEGQZRV-UHFFFAOYSA-N	c1ccc(cc1)c2ccsc2c3ccccc3	DCSJZPJBTJVYHS-UHFFFAOYSA-N	C1C=CC(=C1c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	RZFOAVRHEGQZRV-UHFFFAOYSA-N	c1ccc(cc1)c2ccsc2c3ccccc3	DCSJZPJBTJVYHS-UHFFFAOYSA-N	C1C=CC(=C1c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
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Cc1c(Cl)cccc1Nc2cscc2CC(=O)O	PPRQZERAZZRMTC-UHFFFAOYSA-N	RPBAPBVRPNDURB-UHFFFAOYSA-N	CCc1cscc1Nc2ccccc2C	SMTQRGJWTFALPL-UHFFFAOYSA-N	CCC1=CCC=C1Cc2ccccc2C	KGMCSDGFLCRMHP-UHFFFAOYSA-N	CCC1CCCC1CC2CCCCC2C	AACVIJSESUHQOI-UHFFFAOYSA-N	N(c1ccccc1)c2ccsc2	NUJAFITXCVVTPU-UHFFFAOYSA-N	C(C1=CCC=C1)c2ccccc2	YIYWTNBPUYHPLR-UHFFFAOYSA-N	C(C1CCCC1)C2CCCCC2	AACVIJSESUHQOI-UHFFFAOYSA-N	N(c1ccccc1)c2ccsc2	NUJAFITXCVVTPU-UHFFFAOYSA-N	C(C1=CCC=C1)c2ccccc2	YIYWTNBPUYHPLR-UHFFFAOYSA-N	C(C1CCCC1)C2CCCCC2
CC(=O)NS(=O)(=O)c1cc(ccc1C(=O)O)C2=CC(=O)N(C=C2)C(F)F	DIRIVBQYONNWEG-UHFFFAOYSA-N	ZQAWNHUAXVHSCY-UHFFFAOYSA-N	CN1C=CC(=CC1=O)c2cccc(c2)S(=O)(=O)NC(=O)C	VRUQWOBDNNAKFA-UHFFFAOYSA-N	CC1C=CC(=CC1=C)c2cccc(c2)[C](=C)(=C)CC(=C)C	AGDNXUSUFHFTSI-UHFFFAOYSA-N	CC(C)CC(C)(C)C1CCCC(C1)C2CCC(C)C(C)C2	DNUDULSSNHKPHP-UHFFFAOYSA-N	O=C1NC=CC(=C1)c2ccccc2	CXABGGWSGKOXLF-UHFFFAOYSA-N	C=C1CC=CC(=C1)c2ccccc2	XFILGGKBPBMMAU-UHFFFAOYSA-N	CC1CCCC(C1)C2CCCCC2	DRYJNDPYAFADSD-UHFFFAOYSA-N	C1NC=CC(=C1)c2ccccc2	MCHJEWAZSNQQMN-UHFFFAOYSA-N	C1CC=C(C=C1)c2ccccc2	WVIIMZNLDWSIRH-UHFFFAOYSA-N	C1CCC(CC1)C2CCCCC2
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CCCS(=O)CCc1cc(c2ccc(cc2)S(=O)(=O)C)n(c1C)c3ccc(F)cc3	IFQFTAVRFSFDFF-UHFFFAOYSA-N	KLPFBGALDBCDPY-UHFFFAOYSA-N	CCCS(=O)CCc1cc(c2ccc(cc2)S(=O)(=O)C)n(c1)c3ccccc3	RPCVHILCZGVXQA-UHFFFAOYSA-N	CCCC(=C)CCC1=CC(C(=C1)c2ccc(cc2)[C](=C)(=C)C)c3ccccc3	OOUIAKJMZTYYBW-UHFFFAOYSA-N	CCCC(C)CCC1CC(C2CCCCC2)C(C1)C3CCC(CC3)C(C)(C)C	ZZDIPNSMKJPHTR-UHFFFAOYSA-N	c1ccc(cc1)c2cccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	ZZDIPNSMKJPHTR-UHFFFAOYSA-N	c1ccc(cc1)c2cccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
COc1ccc2c(c1)c(CC(=O)OCC(=O)O)c(C)n2C(=O)c3ccc(Cl)cc3	FSQKKOOTNAMONP-UHFFFAOYSA-N	ARHGQVRJFJFGQI-UHFFFAOYSA-N	CCOC(=O)Cc1cn(C(=O)c2ccccc2)c3ccc(OC)cc13	KZHPDIFEWDLSON-UHFFFAOYSA-N	CCCC(=C)CC1=CC(C(=C)c2ccccc2)c3ccc(CC)cc13	ZWBFDYNHIZVNIF-UHFFFAOYSA-N	CCCC(C)CC1CC(C(C)C2CCCCC2)C3CCC(CC)CC13	DIQDUFVJZPNLJQ-UHFFFAOYSA-N	O=C(c1ccccc1)n2ccc3ccccc23	YREKYICMSDFQHL-UHFFFAOYSA-N	C=C(C1C=Cc2ccccc12)c3ccccc3	ZHTLIYBTWAMBRG-UHFFFAOYSA-N	CC(C1CCCCC1)C2CCC3CCCCC23	NJZQOCCEDXRQJM-UHFFFAOYSA-N	C(c1ccccc1)n2ccc3ccccc23	NBHBNYRLTADHQY-UHFFFAOYSA-N	C(C1C=Cc2ccccc12)c3ccccc3	YFVAAXAVNYXVIE-UHFFFAOYSA-N	C(C1CCCCC1)C2CCC3CCCCC23
CC(=O)OCO\N=[N+](\[O-])/N1CCC[C@H]1COC(=O)Cc2ccc(cc2)c3cc(nn3c4ccc(cc4)S(=O)(=O)N)C(F)(F)F	IQVPFBISJXAZLJ-VJGMZUFXSA-N	HGFPGRHPQAARNW-NFOKUVPFSA-O	CC(=O)OCON=[NH+]N1CCC[C@H]1COC(=O)Cc2ccc(cc2)c3cc(C)nn3c4ccccc4	LUSPSMKWGLMROO-FRYCYORRSA-N	CC(=C)CCCC=CC1CCCC1CCC(=C)Cc2ccc(cc2)C3=CC(=CC3c4ccccc4)C	JWONGSOOOAKPJY-UHFFFAOYSA-N	CC(C)CCCCCC1CCCC1CCC(C)CC2CCC(CC2)C3CC(C)CC3C4CCCCC4	QJNZYNVWSRCZAV-IBGZPJMESA-N	O=C(Cc1ccc(cc1)c2ccnn2c3ccccc3)OC[C@@H]4CCCN4	IJHDHNXRRJOGFC-UHFFFAOYSA-N	C=C(CCC1CCCC1)Cc2ccc(cc2)C3=CC=CC3c4ccccc4	XDQKVENXSMRYPC-UHFFFAOYSA-N	CC(CCC1CCCC1)CC2CCC(CC2)C3CCCC3C4CCCCC4	MDYZPBBOYMQWLZ-FQEVSTJZSA-N	C(Cc1ccc(cc1)c2ccnn2c3ccccc3)OC[C@@H]4CCCN4	QPXIZBVKYQMMSC-UHFFFAOYSA-N	C(CCc1ccc(cc1)C2=CC=CC2c3ccccc3)CC4CCCC4	DYADQPXILDHKLD-UHFFFAOYSA-N	C(CCC1CCC(CC1)C2CCCC2C3CCCCC3)CC4CCCC4
[O-][N+](=O)OCCSSCCOC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl	REGQGNHXLZAOPD-UHFFFAOYSA-N	BLBFJVOVQUSXEP-UHFFFAOYSA-N	CCSSCCOC(=O)Cc1ccccc1Nc2ccccc2	OJSYPGBQDCAFOW-UHFFFAOYSA-N	CCCCCCCC(=C)Cc1ccccc1Cc2ccccc2	DRQMTFPARFIKLP-UHFFFAOYSA-N	CCCCCCCC(C)CC1CCCCC1CC2CCCCC2	DMBHHRLKUKUOEG-UHFFFAOYSA-N	N(c1ccccc1)c2ccccc2	CZZYITDELCSZES-UHFFFAOYSA-N	C(c1ccccc1)c2ccccc2	XXKOQQBKBHUATC-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCCC2	DMBHHRLKUKUOEG-UHFFFAOYSA-N	N(c1ccccc1)c2ccccc2	CZZYITDELCSZES-UHFFFAOYSA-N	C(c1ccccc1)c2ccccc2	XXKOQQBKBHUATC-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCCC2
CCCSCCc1cc(c2ccc(cc2)S(=O)(=O)C)n(c1C)c3ccc(F)cc3	AGLACBUGGFDYJZ-UHFFFAOYSA-N	CBNXCPVEROOBDT-UHFFFAOYSA-N	CCCSCCc1cc(c2ccc(cc2)S(=O)(=O)C)n(c1)c3ccccc3	NKJGTTAFRXFUIY-UHFFFAOYSA-N	CCCCCCC1=CC(C(=C1)c2ccc(cc2)[C](=C)(=C)C)c3ccccc3	FKCCWLPICIPJDD-UHFFFAOYSA-N	CCCCCCC1CC(C2CCCCC2)C(C1)C3CCC(CC3)C(C)(C)C	ZZDIPNSMKJPHTR-UHFFFAOYSA-N	c1ccc(cc1)c2cccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	ZZDIPNSMKJPHTR-UHFFFAOYSA-N	c1ccc(cc1)c2cccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
CC(C)Cc1ccc(cc1)C(C)C(=O)OCc2ccccn2	ACEWLPOYLGNNHV-UHFFFAOYSA-N	IORLXIFNWNHMHF-UHFFFAOYSA-N	CCCc1ccc(cc1)C(C)C(=O)OCc2ccccn2	LYYHSNAZWQQKCZ-UHFFFAOYSA-N	CCCc1ccc(cc1)C(C)C(=C)CCc2ccccc2	URGLRFUCCIROQA-UHFFFAOYSA-N	CCCC1CCC(CC1)C(C)C(C)CCC2CCCCC2	JPZQDGXNTQURKC-UHFFFAOYSA-N	O=C(Cc1ccccc1)OCc2ccccn2	WSXWUIQBZRADPK-UHFFFAOYSA-N	C=C(CCc1ccccc1)Cc2ccccc2	NOLTYVOSQHCGQB-UHFFFAOYSA-N	CC(CCC1CCCCC1)CC2CCCCC2	DIXVHZYDMMJKPC-UHFFFAOYSA-N	C(Cc1ccccc1)OCc2ccccn2	GLJFYGFBITUZOE-UHFFFAOYSA-N	C(CCc1ccccc1)Cc2ccccc2	UWSSRUCETFDRMI-UHFFFAOYSA-N	C(CCC1CCCCC1)CC2CCCCC2
CCCSCCc1cc(c2ccc(cc2)S(=O)(=O)C)n(c1C)c3ccccc3	NNJBPWGKAQCYIE-UHFFFAOYSA-N	CBNXCPVEROOBDT-UHFFFAOYSA-N	CCCSCCc1cc(c2ccc(cc2)S(=O)(=O)C)n(c1)c3ccccc3	NKJGTTAFRXFUIY-UHFFFAOYSA-N	CCCCCCC1=CC(C(=C1)c2ccc(cc2)[C](=C)(=C)C)c3ccccc3	FKCCWLPICIPJDD-UHFFFAOYSA-N	CCCCCCC1CC(C2CCCCC2)C(C1)C3CCC(CC3)C(C)(C)C	ZZDIPNSMKJPHTR-UHFFFAOYSA-N	c1ccc(cc1)c2cccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	ZZDIPNSMKJPHTR-UHFFFAOYSA-N	c1ccc(cc1)c2cccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
FC(F)(F)S(=O)(=O)Nc1ccncc1Nc2cccc(Br)c2	WYMPMNZWERFHGE-UHFFFAOYSA-N	QOJPQADRTOBBQV-UHFFFAOYSA-N	CS(=O)(=O)Nc1ccncc1Nc2ccccc2	GKNBLKXNCCYGSK-UHFFFAOYSA-N	C[C](=C)(=C)Cc1ccccc1Cc2ccccc2	RETPDFYORYWNLG-UHFFFAOYSA-N	CC(C)(C)CC1CCCCC1CC2CCCCC2	JNYYORRROUFDBG-UHFFFAOYSA-N	N(c1ccccc1)c2cccnc2	CZZYITDELCSZES-UHFFFAOYSA-N	C(c1ccccc1)c2ccccc2	XXKOQQBKBHUATC-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCCC2	JNYYORRROUFDBG-UHFFFAOYSA-N	N(c1ccccc1)c2cccnc2	CZZYITDELCSZES-UHFFFAOYSA-N	C(c1ccccc1)c2ccccc2	XXKOQQBKBHUATC-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCCC2
Clc1ccc(cc1)c2nnc(s2)N3C(SCC3=O)c4ccccc4Cl	SJUZQYZLGOXQHA-UHFFFAOYSA-N	KAFYOJQIAKRPMY-UHFFFAOYSA-N	O=C1CSC(N1c2nnc(s2)c3ccccc3)c4ccccc4	IYFNSEDVOPOKME-UHFFFAOYSA-N	C=C1CCC(C1C2=CC=C(C2)c3ccccc3)c4ccccc4	WKHUTUARNWHIQQ-UHFFFAOYSA-N	CC1CCC(C2CCCCC2)C1C3CCC(C3)C4CCCCC4	KAFYOJQIAKRPMY-UHFFFAOYSA-N	O=C1CSC(N1c2nnc(s2)c3ccccc3)c4ccccc4	IYFNSEDVOPOKME-UHFFFAOYSA-N	C=C1CCC(C1C2=CC=C(C2)c3ccccc3)c4ccccc4	WKHUTUARNWHIQQ-UHFFFAOYSA-N	CC1CCC(C2CCCCC2)C1C3CCC(C3)C4CCCCC4	WGQYOBADIMLBJT-UHFFFAOYSA-N	C1CN(C(S1)c2ccccc2)c3nnc(s3)c4ccccc4	ITWXTWQXUCBALO-UHFFFAOYSA-N	C1CC(C(C1)c2ccccc2)C3=CC=C(C3)c4ccccc4	DLPJIUUSCVRVTJ-UHFFFAOYSA-N	C1CCC(CC1)C2CCC(C2)C3CCCC3C4CCCCC4
CC1C(CC(=O)OC(CO[N+](=O)[O-])CO[N+](=O)[O-])c2ccccc2N1C(=O)c3ccc(Cl)cc3	BNYJDGUBOYPWRL-UHFFFAOYSA-N	IJLPJXRNWJRYNU-UHFFFAOYSA-N	CCOC(=O)CC1C(C)N(C(=O)c2ccccc2)c3ccccc13	FOWZQRFEDIKHKC-UHFFFAOYSA-N	CCCC(=C)CC1C(C)C(C(=C)c2ccccc2)c3ccccc13	DMMKMEFFUPLFPY-UHFFFAOYSA-N	CCCC(C)CC1C(C)C(C(C)C2CCCCC2)C3CCCCC13	NJZYEXUZNJGGPH-UHFFFAOYSA-N	O=C(N1CCc2ccccc12)c3ccccc3	MXGNRYPWLNTJJF-UHFFFAOYSA-N	C=C(C1CCc2ccccc12)c3ccccc3	ZHTLIYBTWAMBRG-UHFFFAOYSA-N	CC(C1CCCCC1)C2CCC3CCCCC23	SBWJGPICKZXXOG-UHFFFAOYSA-N	C(N1CCc2ccccc12)c3ccccc3	LPFVAOTWPPGFKI-UHFFFAOYSA-N	C(C1CCc2ccccc12)c3ccccc3	YFVAAXAVNYXVIE-UHFFFAOYSA-N	C(C1CCCCC1)C2CCC3CCCCC23
CC(=O)N1N=C(CC1c2ccc(O)cc2)C3=Cc4ccccc4OC3=O	ZLFLWZZZWALXMR-UHFFFAOYSA-N	STFHOSGUWJJTBC-UHFFFAOYSA-N	CC(=O)N1N=C(CC1c2ccccc2)C3=Cc4ccccc4OC3=O	YWCOIFSJKBJRBX-UHFFFAOYSA-N	CC(=C)C1C=C(CC1c2ccccc2)C3=Cc4ccccc4CC3=C	IEZANXPEBOVZSW-UHFFFAOYSA-N	CC(C)C1CC(CC1C2CCCCC2)C3CC4CCCCC4CC3C	DHQXVLDUFOTNFV-UHFFFAOYSA-N	O=C1Oc2ccccc2C=C1C3=NNC(C3)c4ccccc4	PROBVDOTGVOZCO-UHFFFAOYSA-N	C=C1Cc2ccccc2C=C1C3=CCC(C3)c4ccccc4	KKGQEBGLKOSYEA-UHFFFAOYSA-N	CC1CC2CCCCC2CC1C3CCC(C3)C4CCCCC4	AKVLDZRCXOQBSU-UHFFFAOYSA-N	C1Oc2ccccc2C=C1C3=NNC(C3)c4ccccc4	VWTOQVWDGANIMG-UHFFFAOYSA-N	C1Cc2ccccc2C=C1C3=CCC(C3)c4ccccc4	LHZCLBARCIPNNY-UHFFFAOYSA-N	C1CCC(CC1)C2CCC(C2)C3CCC4CCCCC4C3
NS(=O)(=O)c1ccc(cc1)n2cc(C#N)c(n2)c3ccccc3	YYHQERMVVNSDSL-UHFFFAOYSA-N	IGVQRNJCEKVPTI-UHFFFAOYSA-N	Cc1cn(nc1c2ccccc2)c3ccccc3	QMLBBMAHEOUUOL-UHFFFAOYSA-N	CC1=CC(C=C1c2ccccc2)c3ccccc3	RHVKETSYGNGHNH-UHFFFAOYSA-N	CC1CC(CC1C2CCCCC2)C3CCCCC3	LQUBXCVRJZGBLM-UHFFFAOYSA-N	c1ccc(cc1)c2ccn(n2)c3ccccc3	RFHCXPYNBCYGGP-UHFFFAOYSA-N	C1=CC(=CC1c2ccccc2)c3ccccc3	UEPGKEXXIQJJIP-UHFFFAOYSA-N	C1CCC(CC1)C2CCC(C2)C3CCCCC3	LQUBXCVRJZGBLM-UHFFFAOYSA-N	c1ccc(cc1)c2ccn(n2)c3ccccc3	RFHCXPYNBCYGGP-UHFFFAOYSA-N	C1=CC(=CC1c2ccccc2)c3ccccc3	UEPGKEXXIQJJIP-UHFFFAOYSA-N	C1CCC(CC1)C2CCC(C2)C3CCCCC3
CC(C)(C)c1cc(\C=C\2/SC(=NC2=O)N)cc(c1O)C(C)(C)C	AKTXOQVMWSFEBQ-LCYFTJDESA-N	JXJDPSFHUKWRQM-JYRVWZFOSA-N	CCc1cc(CC)cc(\C=C\2/SC=NC2=O)c1	CTSQJLOSHFSJHK-SFQUDFHCSA-N	CCc1cc(CC)cc(\C=C\2/CC=CC2=C)c1	PJGBPRHVBVUJSC-UHFFFAOYSA-N	CCC1CC(CC)CC(CC2CCCC2C)C1	AVTFXBBFIRVUOI-TWGQIWQCSA-N	O=C1N=CS/C/1=C\c2ccccc2	XAAIFEOJCPDFJJ-JLHYYAGUSA-N	C=C1C=CC/C/1=C\c2ccccc2	WZRHMDQHVAEBQK-UHFFFAOYSA-N	CC1CCCC1CC2CCCCC2	VTTGAYONGJUUEN-POHAHGRESA-N	C1N=CS/C/1=C\c2ccccc2	ZPOSHOKACDECTN-UHFFFAOYSA-N	C1C=CCC1=Cc2ccccc2	YIYWTNBPUYHPLR-UHFFFAOYSA-N	C(C1CCCC1)C2CCCCC2
CC(=O)N1N=C(CC1c2ccc(cc2)[N+](=O)[O-])C3=Cc4ccccc4OC3=O	UFDCMJCWKGSYHN-UHFFFAOYSA-N	STFHOSGUWJJTBC-UHFFFAOYSA-N	CC(=O)N1N=C(CC1c2ccccc2)C3=Cc4ccccc4OC3=O	YWCOIFSJKBJRBX-UHFFFAOYSA-N	CC(=C)C1C=C(CC1c2ccccc2)C3=Cc4ccccc4CC3=C	IEZANXPEBOVZSW-UHFFFAOYSA-N	CC(C)C1CC(CC1C2CCCCC2)C3CC4CCCCC4CC3C	DHQXVLDUFOTNFV-UHFFFAOYSA-N	O=C1Oc2ccccc2C=C1C3=NNC(C3)c4ccccc4	PROBVDOTGVOZCO-UHFFFAOYSA-N	C=C1Cc2ccccc2C=C1C3=CCC(C3)c4ccccc4	KKGQEBGLKOSYEA-UHFFFAOYSA-N	CC1CC2CCCCC2CC1C3CCC(C3)C4CCCCC4	AKVLDZRCXOQBSU-UHFFFAOYSA-N	C1Oc2ccccc2C=C1C3=NNC(C3)c4ccccc4	VWTOQVWDGANIMG-UHFFFAOYSA-N	C1Cc2ccccc2C=C1C3=CCC(C3)c4ccccc4	LHZCLBARCIPNNY-UHFFFAOYSA-N	C1CCC(CC1)C2CCC(C2)C3CCC4CCCCC4C3
NS(=O)(=O)c1ccc(cc1)n2nc(cc2C3=CCN(CCCCO[N+](=O)[O-])CC3)C(F)(F)F	HDDIYOVPLWDDPY-UHFFFAOYSA-N	ATCGJGWISYZHIW-UHFFFAOYSA-N	CCCCN1CCC(=CC1)c2cc(C)nn2c3ccccc3	YZLUHNVBJUHCKC-UHFFFAOYSA-N	CCCCC1CCC(=CC1)C2=CC(=CC2c3ccccc3)C	GIGPDZSGNJFUTM-UHFFFAOYSA-N	CCCCC1CCC(CC1)C2CC(C)CC2C3CCCCC3	IKTHVOCZKZGCEN-UHFFFAOYSA-N	C1CC(=CCN1)c2ccnn2c3ccccc3	HCUWAEGBAIKUIK-UHFFFAOYSA-N	C1CCC(=CC1)C2=CC=CC2c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	IKTHVOCZKZGCEN-UHFFFAOYSA-N	C1CC(=CCN1)c2ccnn2c3ccccc3	HCUWAEGBAIKUIK-UHFFFAOYSA-N	C1CCC(=CC1)C2=CC=CC2c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
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CCCOCCc1cc(c2ccc(cc2)S(=O)(=O)C)n(c1C)c3ccccc3	VYMRHGYLWDUCCA-UHFFFAOYSA-N	VCTRVEZCNSMAMP-UHFFFAOYSA-N	CCCOCCc1cc(c2ccc(cc2)S(=O)(=O)C)n(c1)c3ccccc3	NKJGTTAFRXFUIY-UHFFFAOYSA-N	CCCCCCC1=CC(C(=C1)c2ccc(cc2)[C](=C)(=C)C)c3ccccc3	FKCCWLPICIPJDD-UHFFFAOYSA-N	CCCCCCC1CC(C2CCCCC2)C(C1)C3CCC(CC3)C(C)(C)C	ZZDIPNSMKJPHTR-UHFFFAOYSA-N	c1ccc(cc1)c2cccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3	ZZDIPNSMKJPHTR-UHFFFAOYSA-N	c1ccc(cc1)c2cccn2c3ccccc3	XBINOVBNAGGKHM-UHFFFAOYSA-N	C1=CC(C(=C1)c2ccccc2)c3ccccc3	XDDVPYUEAYKJAG-UHFFFAOYSA-N	C1CCC(CC1)C2CCCC2C3CCCCC3
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CC(=O)OCCOC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl	FVSBLLBPZDBTEY-UHFFFAOYSA-N	FAKKUMCRDVTXER-UHFFFAOYSA-N	CC(=O)OCCOC(=O)Cc1ccccc1Nc2ccccc2	QQPBWYPTDLWNKG-UHFFFAOYSA-N	CC(=C)CCCCC(=C)Cc1ccccc1Cc2ccccc2	UIFALWXEHNELGJ-UHFFFAOYSA-N	CC(C)CCCCC(C)CC1CCCCC1CC2CCCCC2	DMBHHRLKUKUOEG-UHFFFAOYSA-N	N(c1ccccc1)c2ccccc2	CZZYITDELCSZES-UHFFFAOYSA-N	C(c1ccccc1)c2ccccc2	XXKOQQBKBHUATC-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCCC2	DMBHHRLKUKUOEG-UHFFFAOYSA-N	N(c1ccccc1)c2ccccc2	CZZYITDELCSZES-UHFFFAOYSA-N	C(c1ccccc1)c2ccccc2	XXKOQQBKBHUATC-UHFFFAOYSA-N	C(C1CCCCC1)C2CCCCC2