smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C[C@@H]1CNc2[nH+]c(N)nc(N)c2N1)c1ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc1	ZINC000031350053	563107954	/nfs/dbraw/zinc/10/79/54/563107954.db2.gz	GLSBTKIRCIEEJO-AAEUAGOBSA-N	-1	2	458.479	0.031	10	0		JCAELM
CN(C[C@@H]1CNc2nc(N)[nH+]c(N)c2N1)c1ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc1	ZINC000031350053	563107953	/nfs/dbraw/zinc/10/79/53/563107953.db2.gz	GLSBTKIRCIEEJO-AAEUAGOBSA-N	-1	2	458.479	0.031	10	0		JCAELM
CN(C[C@H]1CNc2[nH+]c(N)nc(N)c2N1)c1ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc1	ZINC000031350056	563107968	/nfs/dbraw/zinc/10/79/68/563107968.db2.gz	GLSBTKIRCIEEJO-YPMHNXCESA-N	-1	2	458.479	0.031	10	0		JCAELM
CN(C[C@H]1CNc2nc(N)[nH+]c(N)c2N1)c1ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc1	ZINC000031350056	563107967	/nfs/dbraw/zinc/10/79/67/563107967.db2.gz	GLSBTKIRCIEEJO-YPMHNXCESA-N	-1	2	458.479	0.031	10	0		JCAELM