smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([C@H](O)[C@H](O)C1NNC(S)NN1)[C@@H](O)CO	ZINC000004018034	373053922	/nfs/dbraw/zinc/05/39/22/373053922.db2.gz	OOOJWEASRKBWBV-QTBDOELSSA-N	0	1	268.295	-4.765	40	10		CACBMN
CN1C(=O)NC(=O)C(=CNC(N)=N[N+](=O)[O-])C1=O	ZINC000408536727	277016186	/nfs/dbraw/zinc/01/61/86/277016186.db2.gz	ARODCFVHHLMAHQ-NSCUHMNNSA-N	0	1	256.178	-2.116	40	10		CACBMN
COCCOCCCNC=C1C(=O)NC(=O)NC1=O	ZINC000024335139	372803201	/nfs/dbraw/zinc/80/32/01/372803201.db2.gz	BWNCPNPRLFLGJO-UHFFFAOYSA-N	0	1	271.273	-1.121	40	10		CACBMN
O=C([C@H](O)CO)[C@H](O)[C@H](O)C1NNC(S)NN1	ZINC000004018035	373053875	/nfs/dbraw/zinc/05/38/75/373053875.db2.gz	OOOJWEASRKBWBV-MBMOQRBOSA-N	0	1	268.295	-4.765	40	10		CACBMN
O=C([C@H](O)CO)[C@H](O)[C@H](O)C1NNC(S)NN1	ZINC000004018033	373055647	/nfs/dbraw/zinc/05/56/47/373055647.db2.gz	OOOJWEASRKBWBV-STGXQOJASA-N	0	1	268.295	-4.765	40	10		CACBMN