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)CCN(C)c1ccc2c(=O)n(CCN(C)C)c(=O)n3c4ccccc4c(=O)c1c23	ZINC000005581958	562944328	/nfs/dbraw/zinc/94/43/28/562944328.db2.gz	PLNMWNSPPNPJPB-UHFFFAOYSA-N	0	3	435.528	1.125	1	5		IDBFHN
CN[C@@H](C)C(=O)N[C@H](C(=O)N[C@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1)C(C)(C)C	ZINC000082152190	563173380	/nfs/dbraw/zinc/17/33/80/563173380.db2.gz	QAEZJDXRJBVTSY-XKGZKEIXSA-N	0	3	447.580	1.857	1	5		IDBFHN
CCCn1c(=O)c2ccc(NCCN(C)C)c3c(=O)c4cc([N+](=O)[O-])ccc4n(c1=O)c23	ZINC000027755871	563046826	/nfs/dbraw/zinc/04/68/26/563046826.db2.gz	JMBAJGLMTPTDGA-UHFFFAOYSA-N	0	3	437.456	1.857	1	5		IDBFHN
CN(C)CCCNc1ccc2c(=O)n(CCN(C)C)c(=O)n3c4ccccc4c(=O)c1c23	ZINC000005580959	562944230	/nfs/dbraw/zinc/94/42/30/562944230.db2.gz	FUFIQEAPORJTAW-UHFFFAOYSA-N	0	3	435.528	1.491	1	5		IDBFHN