smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1c2ccc(Oc3ccc4c(c3)C(=O)N(CC3CC[NH2+]CC3)C4=O)cc2C(=O)N1CC1CC[NH2+]CC1	ZINC000001464173	551679616	/nfs/dbraw/zinc/67/96/16/551679616.db2.gz	JEOBVWCJPSCIAA-UHFFFAOYSA-N	2	0	502.571	2.670	10	0		KFAERP
COc1cccc(CC[NH2+][C@@H]2CC(=O)N(c3ccc(N4C(=O)C[C@@H]([NH2+]CCc5cccc(OC)c5)C4=O)cc3)C2=O)c1	ZINC000008412332	553010019	/nfs/dbraw/zinc/01/00/19/553010019.db2.gz	HYJAGMYISHREIA-VSGBNLITSA-N	2	0	570.646	2.632	10	0		KFAERP
COc1cc(N)c(Cl)cc1C(=O)N[C@@H]1CC[N@@H+](CCCCCC(=O)O[C@H]2C[NH+]3CCC2CC3)C[C@@H]1OC	ZINC000013984697	561736173	/nfs/dbraw/zinc/73/61/73/561736173.db2.gz	VGDDOIZXGFJDRC-VJTSUQJLSA-N	2	0	537.101	2.948	10	0	investigational	KFAERP
COc1cccc(CC[NH2+][C@H]2CC(=O)N(c3ccc(N4C(=O)C[C@H]([NH2+]CCc5cccc(OC)c5)C4=O)cc3)C2=O)c1	ZINC000018203546	553610202	/nfs/dbraw/zinc/61/02/02/553610202.db2.gz	HYJAGMYISHREIA-NSOVKSMOSA-N	2	0	570.646	2.632	10	0		KFAERP
C[NH+]1CC[C@]23c4c5c(O)ccc4C[C@H]1[C@H]2C[C@H]([C@@]1(O)CC[C@H]2[C@H]4Cc6ccc(O)c7c6[C@@]2(CC[N@H+]4C)[C@H]1O7)C(=O)[C@H]3O5	ZINC000072399924	553651472	/nfs/dbraw/zinc/65/14/72/553651472.db2.gz	WWFJVDWQNGHXOR-IGJCWJHQSA-N	2	0	570.686	2.662	10	0	in-vitro	KFAERP
COc1cccc(CC[NH2+][C@@H]2CC(=O)N(c3ccc(N4C(=O)C[C@H]([NH2+]CCc5cccc(OC)c5)C4=O)cc3)C2=O)c1	ZINC000103128906	555297201	/nfs/dbraw/zinc/29/72/01/555297201.db2.gz	HYJAGMYISHREIA-HNRBIFIRSA-N	2	0	570.646	2.632	10	0		KFAERP