smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ncc(COP(=O)([O-])[O-])c(C=C2SC(=S)[N-]C2=O)c1[O-]	ZINC000001860836	204021080	/nfs/dbraw/zinc/02/10/80/204021080.db2.gz	WJDPAGLWZIPYMX-WAPJZHGLSA-N	-4	3	362.325	1.194	1	10		FDCFHL
C[C@H](CCC(=O)[O-])N1Cc2c(cc3c(c2[O-])C[C@@H]([C@@H](C)C(=O)[O-])O3)C1=O	ZINC000103291159	209251654	/nfs/dbraw/zinc/25/16/54/209251654.db2.gz	UEYUGQNDRBSZRZ-KKFJDGPESA-N	-3	3	363.366	1.626	1	10		FDCFHL
C/C=C/c1cc2c(c(=O)o1)-c1c([O-])c(O)c(OC)c(C(=O)[O-])c1[C@H](O)O2	ZINC000040934216	208275097	/nfs/dbraw/zinc/27/50/97/208275097.db2.gz	ZFHFTSQJDRLEMK-REMYHPOOSA-N	-2	3	362.290	1.841	1	10		FDCFHL
Cc1c(O)c([O-])c2c(c1C=O)[C@@H]1O[C@H](O2)c2c(C)c([O-])c(O)c(O)c2C1=O	ZINC000103236193	222327848	/nfs/dbraw/zinc/32/78/48/222327848.db2.gz	AHNFXMBOWJVAPB-FUHWJXTLSA-N	-2	3	374.301	1.989	1	10		FDCFHL
C[C@@H](C(=O)[O-])[C@@H]1Cc2c(cc3c(c2[O-])CN([C@@H](C)CCC(=O)[O-])C3=O)O1	ZINC000103291154	222331475	/nfs/dbraw/zinc/33/14/75/222331475.db2.gz	UEYUGQNDRBSZRZ-RWEMILLDSA-N	-3	3	363.366	1.626	1	10		FDCFHL
Cc1[nH][n-]c(=O)c1N=Nc1ccc(S(=O)(=O)[N-]c2nccs2)cc1	ZINC000100905056	222256207	/nfs/dbraw/zinc/25/62/07/222256207.db2.gz	GVOQEMCDLZKQPG-JCNXWTJJSA-N	-2	3	364.412	1.902	1	10		FDCFHL
CC[C@]1(O)Cc2c([O-])c3c(cc2[C@@H](O)C1)C(=O)c1c([O-])cccc1C3=O	ZINC000013398238	220066597	/nfs/dbraw/zinc/06/65/97/220066597.db2.gz	FOBDELRRPLBMOS-XOBRGWDASA-N	-2	3	354.358	1.994	1	10		FDCFHL