smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cccc([C@H]2[NH2+][C@@](C)(C(=O)[O-])[C@H]3C(=O)N(C(C)C)C(=O)[C@H]23)c1[O-]	ZINC000103004792	206233185	/nfs/dbraw/zinc/23/31/85/206233185.db2.gz	WNPOIOPYLLSBQR-NVAPZFDKSA-N	-1	3	362.382	0.898	1	10		FCCFHM
COc1cccc([C@H]2[NH2+][C@](C)(C(=O)[O-])[C@@H]3C(=O)N(C(C)C)C(=O)[C@H]32)c1[O-]	ZINC000104058440	222349095	/nfs/dbraw/zinc/34/90/95/222349095.db2.gz	WNPOIOPYLLSBQR-WLHTULFXSA-N	-1	3	362.382	0.898	1	10		FCCFHM
COc1cccc([C@@H]2[NH2+][C@@](C)(C(=O)[O-])[C@H]3C(=O)N(C(C)C)C(=O)[C@H]23)c1[O-]	ZINC000103004789	222318204	/nfs/dbraw/zinc/31/82/04/222318204.db2.gz	WNPOIOPYLLSBQR-CVXDAYKESA-N	-1	3	362.382	0.898	1	10		FCCFHM
COc1cccc([C@H]2[NH2+][C@](C)(C(=O)[O-])[C@H]3C(=O)N(C(C)C)C(=O)[C@H]23)c1[O-]	ZINC000013133102	220059610	/nfs/dbraw/zinc/05/96/10/220059610.db2.gz	WNPOIOPYLLSBQR-OFEPTWOUSA-N	-1	3	362.382	0.898	1	10		FCCFHM