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[nH]c(=S)[nH]c2c([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)nsc21	ZINC000005542696	181255543	/nfs/dbraw/zinc/25/55/43/181255543.db2.gz	ANMZLGUZOQSFCR-ANINJMQJSA-N	0	2	317.348	-0.804	1	0		DBAFLN
O=c1[nH]cnc2c(C[NH2+][C@@H](CO)CO[P@@](=O)([O-])O)c[nH]c21	ZINC000096917765	185391460	/nfs/dbraw/zinc/39/14/60/185391460.db2.gz	OICBWUCRIUYBNO-ZETCQYMHSA-N	0	2	318.226	-0.777	1	0		DBAFLN
O=c1[nH]cnc2c(C[NH2+][C@@H](CO)CO[P@](=O)([O-])O)c[nH]c21	ZINC000096917765	185391461	/nfs/dbraw/zinc/39/14/61/185391461.db2.gz	OICBWUCRIUYBNO-ZETCQYMHSA-N	0	2	318.226	-0.777	1	0		DBAFLN
O=c1[nH]c(=S)[nH]c2c([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)nsc21	ZINC000005542698	181255161	/nfs/dbraw/zinc/25/51/61/181255161.db2.gz	ANMZLGUZOQSFCR-RVEQKTNFSA-N	0	2	317.348	-0.804	1	0		DBAFLN
O=c1[nH]c(=S)[nH]c2c([C@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)nsc21	ZINC000195517397	201396802	/nfs/dbraw/zinc/39/68/02/201396802.db2.gz	ANMZLGUZOQSFCR-PSDFELBUSA-N	0	2	317.348	-0.804	1	0		DBAFLN
NS(=O)(=O)c1nnc(N2C(=O)c3cccnc3C2=O)s1	ZINC000003927774	181057985	/nfs/dbraw/zinc/05/79/85/181057985.db2.gz	ABZUQTACHNXKQR-UHFFFAOYSA-N	0	2	311.304	-0.619	1	0		DBAFLN
COc1ccccc1NS(=O)(=O)c1c(N)[nH]c(=O)[nH]c1=O	ZINC000015952729	182026754	/nfs/dbraw/zinc/02/67/54/182026754.db2.gz	QJRSLGISKUJFDZ-UHFFFAOYSA-N	0	2	312.307	-0.545	3	0		DBAFLN
O=C(c1ccco1)[C@@H]1SCC(=O)N1Nc1nc(O)cc(=O)[nH]1	ZINC000005838647	181288699	/nfs/dbraw/zinc/28/86/99/181288699.db2.gz	IZEMAPASCCZASY-NSHDSACASA-N	0	2	322.302	-0.729	1	0		DBAFLN
O=C(c1ccco1)[C@@H]1SCC(=O)N1NC1=NC(=O)CC(=O)N1	ZINC000005838647	181288701	/nfs/dbraw/zinc/28/87/01/181288701.db2.gz	IZEMAPASCCZASY-NSHDSACASA-N	0	2	322.302	-0.729	1	0		DBAFLN
O=c1[nH]c(=S)[nH]c2c([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)nsc21	ZINC000195517395	201397455	/nfs/dbraw/zinc/39/74/55/201397455.db2.gz	ANMZLGUZOQSFCR-PDTWDYGBSA-N	0	2	317.348	-0.804	1	0		DBAFLN