smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1[N-]C(=S)NC(=O)C1=CNCCO	ZINC000006360458	188103186	/nfs/dbraw/zinc/10/31/86/188103186.db2.gz	DYJYZWSJNDGLIW-UHFFFAOYSA-N	-1	1	215.234	-2.017	50	10		BACAMM
O=C1[N-]C(=S)NC(=O)C1=CNCCCO	ZINC000006620285	187248267	/nfs/dbraw/zinc/24/82/67/187248267.db2.gz	WCMPTFQGHYKBNQ-UHFFFAOYSA-N	-1	1	229.261	-1.627	50	10		BACAMM
O=C1[N-]C(=S)NC(=O)C1=CN1CCOCC1	ZINC000008656215	372829948	/nfs/dbraw/zinc/82/99/48/372829948.db2.gz	HNITZUYJBSOGQH-UHFFFAOYSA-N	-1	1	241.272	-1.267	50	10		BACAMM
O=C1[N-]C(=S)NC(=O)C1=CNn1cnnc1	ZINC000017204113	187252248	/nfs/dbraw/zinc/25/22/48/187252248.db2.gz	AGNYVMCKJRQLHH-UHFFFAOYSA-N	-1	1	238.232	-1.764	50	10		BACAMM
O=C([O-])CNC=C1C(=O)NC(=O)NC1=O	ZINC000019701752	384534461	/nfs/dbraw/zinc/53/44/61/384534461.db2.gz	PVTXMDYAYOSEQQ-UHFFFAOYSA-N	-1	1	213.149	-2.090	50	10		BACAMM
O=C([O-])CCCNC=C1C(=O)NC(=O)NC1=O	ZINC000019939695	384559805	/nfs/dbraw/zinc/55/98/05/384559805.db2.gz	JTWYSCRLXDITNU-UHFFFAOYSA-N	-1	1	241.203	-1.309	50	10		BACAMM
O=C1[N-]C(=S)NC(=O)C1=CNc1nn[nH]n1	ZINC000100922820	187290925	/nfs/dbraw/zinc/29/09/25/187290925.db2.gz	YPNBBECOFZVMKH-UHFFFAOYSA-N	-1	1	239.220	-1.974	50	10		BACAMM