smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CO/N=C(\C[NH3+])[C@@H]1C[C@H](SC2=C(C(=O)[O-])N3C(=O)[C@H]([C@@H](C)O)[C@H]3[C@H]2C)CN1	ZINC000028709431	207347152	/nfs/dbraw/zinc/34/71/52/207347152.db2.gz	SAPJIYPYOWDKGF-QFOFMFPASA-N	0	1	398.485	-0.435	1	30		GBEFMN
NCC(=O)N1CC2(C[C@H]1C(=O)NCCCCCC(=O)NO)SCCS2	ZINC000072106075	222206146	/nfs/dbraw/zinc/20/61/46/222206146.db2.gz	VGVFAEMPJQPSNY-NSHDSACASA-N	0	1	390.531	-0.096	1	30		GBEFMN
NS(=O)(=O)c1ccc(N=Nc2c(=O)[nH]n3c2[nH]c2c(c3=O)CCCC2)cc1	ZINC000100560427	211389049	/nfs/dbraw/zinc/38/90/49/211389049.db2.gz	FUJQEWDOUPMCMC-MOSHPQCFSA-N	0	1	388.409	-0.331	3	30		GBEFMN