smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CCC1(CC=C)CCCC[N@@H+]1Cc1cccc(OC[C@@H](O)C[NH+]2CCC(O)CC2)c1	ZINC000012583106	518690785	/nfs/dbraw/zinc/69/07/85/518690785.db2.gz	RAQUUJDTKZMIQY-DEOSSOPVSA-N	2	1	428.617	3.760	10	30		IHEEMP
C=CCC1(CC=C)CCCC[N@@H+]1Cc1cccc(OC[C@H](O)C[NH+]2CCC(O)CC2)c1	ZINC000012583099	518690142	/nfs/dbraw/zinc/69/01/42/518690142.db2.gz	RAQUUJDTKZMIQY-XMMPIXPASA-N	2	1	428.617	3.760	10	30		IHEEMP
CC(C)([NH3+])c1ccc(-c2nc(Nc3ccc(CC[NH+]4CCOCC4)cc3)ncc2C#N)cc1	ZINC000006733324	562948257	/nfs/dbraw/zinc/94/82/57/562948257.db2.gz	MROGTPNQSHMKIG-UHFFFAOYSA-N	2	1	442.567	3.827	10	30		IHEEMP