smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CCc1cccc(C(=O)[O-])c1[S-]	140044707	571992673	/nfs/dbraw/zinc/99/26/73/571992673.db2.gz	KISBKLMVQLSIKK-UHFFFAOYSA-N	-2	0	194.255	2.402	10	30		AEEERL
N#Cc1cc([S-])ccc1[S-]	117658797	573355308	/nfs/dbraw/zinc/35/53/08/573355308.db2.gz	HQSWCISCHUEJMT-UHFFFAOYSA-N	-2	0	167.258	2.136	10	30		AEEERL
N#Cc1cc([S-])c([S-])cc1C#N	90563125	343676412	/nfs/dbraw/zinc/67/64/12/343676412.db2.gz	CULQAYGWLYMTSX-UHFFFAOYSA-N	-2	0	192.268	2.007	10	30		AEEERL
O=C(C=CO)c1ccc(Cl)cc1[O-]	223921986	573203157	/nfs/dbraw/zinc/20/31/57/573203157.db2.gz	NYJAFUTUAFQSHD-ARJAWSKDSA-N	-2	0	198.605	2.300	10	30		AEEERL
N#Cc1c([O-])sc2cccc(O)c12	306649507	573537375	/nfs/dbraw/zinc/53/73/75/573537375.db2.gz	QLNLDOFNZQLYGB-UHFFFAOYSA-N	-2	0	191.211	2.184	10	30		AEEERL
C=CCc1ccc([S-])c(C(=O)[O-])c1	144571412	573669048	/nfs/dbraw/zinc/66/90/48/573669048.db2.gz	YLZMBHBSFXODTR-UHFFFAOYSA-N	-2	0	194.255	2.402	10	30		AEEERL