smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1c(S(=O)(=O)[N-]c2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)cnn1-c1ccc(Cl)cc1	ZINC000800728452	1067162570	/nfs/dbraw/zinc/16/25/70/1067162570.db2.gz	PKRJSEMMUPEFFP-UHFFFAOYSA-N	-1	0	500.005	4.643	20	10		KJCDRM
Cc1ccccc1[C@H](Oc1c(O)c(S(=O)(=O)[O-])cc2c1C(=O)c1ccccc1C2=O)c1ccccc1	ZINC001227506668	1067169319	/nfs/dbraw/zinc/16/93/19/1067169319.db2.gz	OBHFJMXFTVMCMU-HHHXNRCGSA-N	-1	0	500.528	4.891	20	10		KJCDRM
Cc1ccccc1[C@@H](Oc1c(O)c(S(=O)(=O)[O-])cc2c1C(=O)c1ccccc1C2=O)c1ccccc1	ZINC001227506679	1067169393	/nfs/dbraw/zinc/16/93/93/1067169393.db2.gz	OBHFJMXFTVMCMU-MHZLTWQESA-N	-1	0	500.528	4.891	20	10		KJCDRM
O=C1c2ccccc2C(=O)c2c1cc(S(=O)(=O)[O-])c(O)c2OC1c2ccccc2Oc2ccccc21	ZINC001227511809	1067169347	/nfs/dbraw/zinc/16/93/47/1067169347.db2.gz	VCWBBOFZTROUBF-UHFFFAOYSA-N	-1	0	500.484	4.688	20	10		KJCDRM
Cc1ccc([C@H](Oc2c(O)c(S(=O)(=O)[O-])cc3c2C(=O)c2ccccc2C3=O)c2ccccc2)cc1	ZINC001227512011	1067169377	/nfs/dbraw/zinc/16/93/77/1067169377.db2.gz	XWCZQFRXLAXTLR-HHHXNRCGSA-N	-1	0	500.528	4.891	20	10		KJCDRM
Cc1ccc([C@@H](Oc2c(O)c(S(=O)(=O)[O-])cc3c2C(=O)c2ccccc2C3=O)c2ccccc2)cc1	ZINC001227512012	1067169427	/nfs/dbraw/zinc/16/94/27/1067169427.db2.gz	XWCZQFRXLAXTLR-MHZLTWQESA-N	-1	0	500.528	4.891	20	10		KJCDRM