O=C(O)Cc1ccc(CCOc2ccc(C[C@@H]3SC(=O)NC3=O)cc2)nc1	ZINC000001482949	24/78/04/212247804	OIQJTMMAMWFMQR-INIZCTEOSA-N	-1	386.429	GE	2.224	2	Anodyne	low	GEAALM	O=C([O-])Cc1ccc(CCOc2ccc(C[C@@H]3SC(=O)NC3=O)cc2)nc1	in-vitro
O=C(O)Cc1ccc(CCOc2ccc(C[C@@H]3SC(=O)NC3=O)cc2)nc1	ZINC000001482949	24/78/02/212247802	OIQJTMMAMWFMQR-INIZCTEOSA-N	-2	386.429	GE	2.224	0	Anodyne	ref	GEAARL	O=C([O-])Cc1ccc(CCOc2ccc(C[C@@H]3SC(=O)[N-]C3=O)cc2)nc1	in-vitro
O=C(O)Cc1ccc(CCOc2ccc(C[C@H]3SC(=O)NC3=O)cc2)nc1	ZINC000003784710	18/94/70/560189470	OIQJTMMAMWFMQR-MRXNPFEDSA-N	-1	386.429	GE	2.224	2	Anodyne	low	GEAALM	O=C([O-])Cc1ccc(CCOc2ccc(C[C@H]3SC(=O)NC3=O)cc2)nc1	in-vitro
O=C(O)Cc1ccc(CCOc2ccc(C[C@H]3SC(=O)NC3=O)cc2)nc1	ZINC000003784710	18/94/68/560189468	OIQJTMMAMWFMQR-MRXNPFEDSA-N	-2	386.429	GE	2.224	0	Anodyne	ref	GEAARL	O=C([O-])Cc1ccc(CCOc2ccc(C[C@H]3SC(=O)[N-]C3=O)cc2)nc1	in-vitro
CCc1c2c(nc3ccc(O)cc13)-c1cc3c(c(=O)n1C2)COC(=O)[C@]3(O)CC	ZINC000004099013	12/27/47/560122747	FJHBVJOVLFPMQE-QFIPXVFZSA-N	0	392.411	GE	2.348	0	Anodyne	ref	GEAARN	CCc1c2c(nc3ccc(O)cc13)-c1cc3c(c(=O)n1C2)COC(=O)[C@]3(O)CC	world biogenic
COc1cc2nc(N(C)CCCNC(=O)c3ccco3)nc(N)c2cc1OC	ZINC000026500431	42/62/82/570426282	CNKVWVXXVMNSQJ-UHFFFAOYSA-N	1	385.424	GE	2.079	2	Anodyne	low	GEAALO	COc1cc2nc(N(C)CCCNC(=O)c3ccco3)[nH+]c(N)c2cc1OC	in-vitro
COc1cc2nc(N(C)CCCNC(=O)c3ccco3)nc(N)c2cc1OC	ZINC000026500431	42/62/80/570426280	CNKVWVXXVMNSQJ-UHFFFAOYSA-N	1	385.424	GE	2.079	1	Anodyne	mid	GEAAMO	COc1cc2[nH+]c(N(C)CCCNC(=O)c3ccco3)nc(N)c2cc1OC	in-vitro
COc1cc2nc(N(C)CCCNC(=O)c3ccco3)nc(N)c2cc1OC	ZINC000026500431	42/62/77/570426277	CNKVWVXXVMNSQJ-UHFFFAOYSA-N	0	385.424	GE	2.079	0	Anodyne	ref	GEAARN	COc1cc2nc(N(C)CCCNC(=O)c3ccco3)nc(N)c2cc1OC	in-vitro
O=C(O)c1cn(C2CC2)c2c(O)c(N3C[C@@H]4CCCN[C@@H]4C3)c(F)cc2c1=O	ZINC000065742956	13/48/62/222134862	IRASTQSQRDRSEH-ZUZCIYMTSA-N	-1	387.411	GE	2.067	3	Anodyne	high	GEAAHM	O=C([O-])c1cn(C2CC2)c2c([O-])c(N3C[C@@H]4CCC[NH2+][C@@H]4C3)c(F)cc2c1=O	in-vitro
O=C(O)c1cn(C2CC2)c2c(O)c(N3C[C@@H]4CCCN[C@@H]4C3)c(F)cc2c1=O	ZINC000065742956	13/48/58/222134858	IRASTQSQRDRSEH-ZUZCIYMTSA-N	0	387.411	GE	2.067	0	Anodyne	ref	GEAARN	O=C([O-])c1cn(C2CC2)c2c(O)c(N3C[C@@H]4CCC[NH2+][C@@H]4C3)c(F)cc2c1=O	in-vitro
CCOC(=O)[C@H](CCC1CCCCC1)N[C@@H](C)C(=O)N1CCC[C@@H]1C(=O)O	ZINC000067665046	01/44/23/211014423	ZARBDUSKHGGCSR-BHYGNILZSA-N	-1	382.501	GE	2.332	0	Anodyne	ref	GEABRM	CCOC(=O)[C@H](CCC1CCCCC1)N[C@@H](C)C(=O)N1CCC[C@@H]1C(=O)[O-]	in-vitro
CCOC(=O)[C@H](CCC1CCCCC1)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O	ZINC000067665048	15/36/47/222153647	ZARBDUSKHGGCSR-XIRDDKMYSA-N	-1	382.501	GE	2.332	0	Anodyne	ref	GEAARM	CCOC(=O)[C@H](CCC1CCCCC1)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)[O-]	in-vitro
CCC[C@H](N[C@@H](C)C(=O)N1[C@H](C(=O)O)C[C@@H]2CCCC[C@@H]21)C(=O)OC(C)C	ZINC000067665306	01/46/68/211014668	CEIYXTQJLBUCRQ-WOYTXXSLSA-N	-1	382.501	GE	2.329	0	Anodyne	ref	GEABRM	CCC[C@H](N[C@@H](C)C(=O)N1[C@H](C(=O)[O-])C[C@@H]2CCCC[C@@H]21)C(=O)OC(C)C	in-vitro