smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)C[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)[O-]	ZINC000003811390	569254814	/nfs/dbraw/zinc/25/48/14/569254814.db2.gz	IMIVWAUMTAIVPJ-XUXIUFHCSA-N	-1	3	402.492	-1.043	10	0		HAAEHM
N[C@@H](CCCC[NH3+])C(=O)NCC(=O)N[C@@H](CC(=O)[O-])C(=O)N[C@@H](CO)C(=O)[O-]	ZINC000015721327	568976688	/nfs/dbraw/zinc/97/66/88/568976688.db2.gz	XCGXUKBVSBWLPJ-GUBZILKMSA-N	-1	3	405.408	-3.920	10	0		HAAEHM
CC1C2C[NH+]=C3NC(C(O)c4cc(=O)[n-]c(=O)[nH]4)CC(CC1OS(=O)(=O)[O-])N32	ZINC000096347829	559110083	/nfs/dbraw/zinc/11/00/83/559110083.db2.gz	LHJPHMKIGRLKDR-HYFWBKMBSA-N	-1	3	415.428	-1.905	10	0		HAAEHM