smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1=NC(=NNc2ccccc2)C(COP(=O)([O-])[O-])=C(COP(=O)([O-])[O-])C1=O	ZINC000013861589	563012792	/nfs/dbraw/zinc/01/27/92/563012792.db2.gz	ZBRSNWWNTFRHJQ-WUKNDPDISA-N	-4	0	433.250	2.730	1	10		IFCFRL
CC1=NC(=NNc2cc(S(=O)(=O)[O-])ccc2Cl)C(C[P@@](=O)([O-])O)=C(C=O)C1=O	ZINC000027092533	563039298	/nfs/dbraw/zinc/03/92/98/563039298.db2.gz	ATSGCKPXOYZTMH-ISLYRVAYSA-N	-2	0	449.765	2.901	1	10		IFCFRL
Nc1c(S(=O)(=O)[O-])cc(Nc2ccccc2C(=O)[O-])c2c1C(=O)c1ccccc1C2=O	ZINC000040953702	563114277	/nfs/dbraw/zinc/11/42/77/563114277.db2.gz	CRGRFFSHCCZVQW-UHFFFAOYSA-N	-2	0	438.417	2.733	1	10		IFCFRL
Nc1c(S(=O)(=O)[O-])cc(Nc2ccc(C(=O)[O-])cc2)c2c1C(=O)c1ccccc1C2=O	ZINC000045389821	563133992	/nfs/dbraw/zinc/13/39/92/563133992.db2.gz	QNQAEGCXDAVKAX-UHFFFAOYSA-N	-2	0	438.417	2.733	1	10		IFCFRL
O=C([O-])c1ccc(C(=O)N2CCCCC2)c([N-]S(=O)(=O)c2cccc3nsnc32)c1	ZINC000035064881	563089152	/nfs/dbraw/zinc/08/91/52/563089152.db2.gz	JJXOTJJVZIXVAX-UHFFFAOYSA-N	-2	0	446.510	2.816	1	10		IFCFRL
O=c1oc2c([O-])c(Oc3ccc(O)c(O)c3O)cc3c(=O)oc4c(O)c([O-])cc1c4c32	ZINC000015150733	563017680	/nfs/dbraw/zinc/01/76/80/563017680.db2.gz	LGMNKSBINQXDAI-UHFFFAOYSA-N	-2	0	426.289	2.516	1	10		IFCFRL
Nc1c(S(=O)(=O)[O-])cc(Nc2cccc(C(=O)[O-])c2)c2c1C(=O)c1ccccc1C2=O	ZINC000013509468	562991050	/nfs/dbraw/zinc/99/10/50/562991050.db2.gz	DNGXTKJLUVIIRF-UHFFFAOYSA-N	-2	0	438.417	2.733	1	10		IFCFRL