O=C(O)c1[nH]c(=O)[nH]c(=O)c1CN1CCC(Cc2ccccc2)CC1	ZINC000001432489	84/59/79/440845979	PDIOUUAXUGLNSO-UHFFFAOYSA-N	-1	343.383	ED	1.216	3	Anodyne	high	EDAAHM	O=C([O-])c1[nH]c(=O)[n-]c(=O)c1C[NH+]1CCC(Cc2ccccc2)CC1	in-vitro biogenic
O=C(O)c1[nH]c(=O)[nH]c(=O)c1CN1CCC(Cc2ccccc2)CC1	ZINC000001432489	84/59/73/440845973	PDIOUUAXUGLNSO-UHFFFAOYSA-N	0	343.383	ED	1.216	0	Anodyne	ref	EDAARN	O=C([O-])c1[nH]c(=O)[nH]c(=O)c1C[NH+]1CCC(Cc2ccccc2)CC1	in-vitro biogenic
O=C(O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	ZINC000002689535	87/25/38/440872538	JBPARSXZNLGELM-UHFFFAOYSA-N	-2	335.337	ED	1.957	3	Anodyne	high	EDAAHL	O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc3c(c2)OCCO3)cc1	 
O=C(O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	ZINC000002689535	87/25/25/440872525	JBPARSXZNLGELM-UHFFFAOYSA-N	-1	335.337	ED	1.957	0	Anodyne	ref	EDAARM	O=C([O-])c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1	 
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)O)c12	ZINC000003356936	01/70/23/210017023	GENJQCQDMUDBOT-SNVBAGLBSA-N	-1	335.385	ED	1.675	0	Anodyne	ref	EDAARM	Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)[O-])c12	 
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)O)c12	ZINC000004205061	14/52/37/210145237	GENJQCQDMUDBOT-JTQLQIEISA-N	-1	335.385	ED	1.675	0	Anodyne	ref	EDAARM	Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)[O-])c12	 
COc1ccc(-c2cc(C(=O)O)nn2[C@@H]2CCS(=O)(=O)C2)cc1	ZINC000007952079	07/72/18/441077218	UARGZOWSWBCEAD-LLVKDONJSA-N	-1	336.369	ED	1.617	0	Anodyne	ref	EDAARM	COc1ccc(-c2cc(C(=O)[O-])nn2[C@@H]2CCS(=O)(=O)C2)cc1	 
COc1ccc(-c2cc(C(=O)O)nn2[C@H]2CCS(=O)(=O)C2)cc1	ZINC000007952082	07/69/83/441076983	UARGZOWSWBCEAD-NSHDSACASA-N	-1	336.369	ED	1.617	0	Anodyne	ref	EDAARM	COc1ccc(-c2cc(C(=O)[O-])nn2[C@H]2CCS(=O)(=O)C2)cc1	 
Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C(C)C)cc(C(=O)O)c12	ZINC000008986122	80/63/37/302806337	MUFBSSSLHHZERP-SNVBAGLBSA-N	-1	337.401	ED	1.921	0	Anodyne	ref	EDAARM	Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C(C)C)cc(C(=O)[O-])c12	 
Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C(C)C)cc(C(=O)O)c12	ZINC000008986128	80/64/10/302806410	MUFBSSSLHHZERP-JTQLQIEISA-N	-1	337.401	ED	1.921	0	Anodyne	ref	EDAARM	Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C(C)C)cc(C(=O)[O-])c12	 
CCOC(=O)N1CCN([C@@H]2CC(=O)N(c3ccccc3)C2=O)CC1	ZINC000019827308	07/34/44/212073444	BKPKGHNLPXEDNE-CQSZACIVSA-N	0	331.372	ED	1.093	0	Anodyne	ref	EDAARN	CCOC(=O)N1CCN([C@@H]2CC(=O)N(c3ccccc3)C2=O)CC1	 
CCOC(=O)N1CCN([C@H]2CC(=O)N(c3ccccc3)C2=O)CC1	ZINC000100507290	10/15/26/219101526	BKPKGHNLPXEDNE-AWEZNQCLSA-N	0	331.372	ED	1.093	0	Anodyne	ref	EDAARN	CCOC(=O)N1CCN([C@H]2CC(=O)N(c3ccccc3)C2=O)CC1	 
N#Cc1cn(Cc2nc(-c3ccccc3Cl)no2)c(=O)nc1O	ZINC000504222160	30/82/84/268308284	DCCAIOBSKLWRBH-UHFFFAOYSA-N	-1	329.703	ED	1.572	0	Mild	ref	EDEBRM	N#Cc1cn(Cc2nc(-c3ccccc3Cl)no2)c(=O)[n-]c1=O