smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(CNC(=O)[C@@H]1CC(=O)NC(=O)N1)c1ccc([O-])c(O)c1	ZINC001144335987	781369292	/nfs/dbraw/zinc/36/92/92/781369292.db2.gz	GUTSAHMTPPJAEY-ZETCQYMHSA-N	-1	1	307.262	-1.005	20	10		DACDMM
O=C(C[C@@H]1NC(=O)CNC1=O)NCC(=O)c1ccc([O-])c(O)c1	ZINC001183730720	781735497	/nfs/dbraw/zinc/73/54/97/781735497.db2.gz	HBCZGVMDHCNQJI-QMMMGPOBSA-N	-1	1	321.289	-1.599	20	10		DACDMM
O=C(CN1CC(=O)NC1=O)NCC(=O)c1ccc([O-])c(O)c1	ZINC001142093597	775598520	/nfs/dbraw/zinc/59/85/20/775598520.db2.gz	NOHNFFMEIWGTGT-UHFFFAOYSA-N	-1	1	307.262	-1.052	20	10		DACDMM
O=C(CN1C(=O)CNC1=O)NCC(=O)c1ccc([O-])c(O)c1	ZINC001180388006	781672119	/nfs/dbraw/zinc/67/21/19/781672119.db2.gz	XECDTGAEERIQDK-UHFFFAOYSA-N	-1	1	307.262	-1.052	20	10		DACDMM
NC(=O)[C@H](CO)NC(=O)c1cc2cc(O)c([O-])cc2oc1=O	ZINC001155235124	779731886	/nfs/dbraw/zinc/73/18/86/779731886.db2.gz	YOZXHWDVPLWGGL-ZETCQYMHSA-N	-1	1	308.246	-1.220	20	10		DACDMM
NC(=O)[C@@H](CO)NC(=O)c1cc2cc(O)c([O-])cc2oc1=O	ZINC001155235116	779731453	/nfs/dbraw/zinc/73/14/53/779731453.db2.gz	YOZXHWDVPLWGGL-SSDOTTSWSA-N	-1	1	308.246	-1.220	20	10		DACDMM