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(=O)N[C@@H]1C(=O)N2C(C(=O)[O-])=C(C=CSc3n[nH]c(=O)c(=O)n3CC=O)CS[C@H]12)c1csc(N)n1	ZINC000004215269	552449842	/nfs/dbraw/zinc/44/98/42/552449842.db2.gz	WJXAHFZIHLTPFR-JLRJEBFFSA-N	-1	2	594.613	-1.436	10	30	in-man	KAEELM
C[NH+](C)[C@@H]1C([O-])=C(C(=O)N[C@H](C(=O)[O-])N2CC[NH+](CCO)CC2)C(=O)[C@@]2(O)C(=O)C3=C([O-])c4c(O)cccc4[C@@](C)(O)[C@H]3C[C@@H]12	ZINC000022462747	561759426	/nfs/dbraw/zinc/75/94/26/561759426.db2.gz	HRWVXKVRSNICJQ-USKNGENDSA-N	-1	2	630.651	-1.563	10	30	in-man	KAEELM