smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1ncnc(Nc2cc(CNC(=O)C(F)(F)F)c(O)c(-c3ccc(Cl)cc3)c2)n1	ZINC000063298107	563152267	/nfs/dbraw/zinc/15/22/67/563152267.db2.gz	IUUVJFSKAMMCEA-UHFFFAOYSA-N	0	2	438.797	3.402	1	10		IGCFLN
Cc1ccc(S(=O)(=O)Nc2c(O)c3ccccc3c(O)c2-n2cnc3ccccc32)cc1	ZINC000001650360	562923783	/nfs/dbraw/zinc/92/37/83/562923783.db2.gz	YZMFREUHIKGBFH-YADHBBJMSA-N	0	2	445.500	3.312	1	10		IGCFLN
COc1cc(OC)c(C(=O)c2ccccc2Br)c([O-])c1CN1CC[NH+](C)CC1	ZINC000049070473	563137702	/nfs/dbraw/zinc/13/77/02/563137702.db2.gz	RVLHOTVUKMRJNN-UHFFFAOYSA-N	0	2	449.345	3.150	1	10		IGCFLN
Cc1ccc(S(=O)(=O)Nc2c(O)c3ccccc3c(O)c2-n2cnc3ccccc32)cc1	ZINC000001650359	562923765	/nfs/dbraw/zinc/92/37/65/562923765.db2.gz	YZMFREUHIKGBFH-FGZHOGPDSA-N	0	2	445.500	3.312	1	10		IGCFLN
COC(=O)/C(=C\c1ccc(O)c(O)c1)c1c(O)cc(/C=C/c2ccc(O)c(O)c2)oc1=O	ZINC000028647751	563060944	/nfs/dbraw/zinc/06/09/44/563060944.db2.gz	KSCNEEIWGUYULB-GMKMYQCMSA-N	0	2	438.388	3.052	1	10		IGCFLN