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(=NNc2cc3c(cc([N+](=O)[O-])cc3S(=O)(=O)[O-])c(S(=O)(=O)[O-])c2)C(CO[P@](=O)([O-])O)=C(C=O)C1=O	ZINC000017611390	553598814	/nfs/dbraw/zinc/59/88/14/553598814.db2.gz	VKVLKKXYCNZTAH-UZYVYHOESA-N	-3	2	606.440	0.615	40	0		KCABLL
CC1=NC(=NNc2cc3c(cc([N+](=O)[O-])cc3S(=O)(=O)[O-])c(S(=O)(=O)[O-])c2)C(CO[P@@](=O)([O-])O)=C(C=O)C1=O	ZINC000017611390	553598812	/nfs/dbraw/zinc/59/88/12/553598812.db2.gz	VKVLKKXYCNZTAH-UZYVYHOESA-N	-3	2	606.440	0.615	40	0		KCABLL
CCCSc1nc2c(ncn2[C@H]2O[C@@H](CO[P@](=O)([O-])O[P@](=O)([O-])C(F)(F)[P@](=O)([O-])O)[C@H](O)[C@H]2O)c(N)n1	ZINC001529084368	1066288240	/nfs/dbraw/zinc/28/82/40/1066288240.db2.gz	ZQXUQOHLHUWLSA-CCQAIOMUSA-N	-3	2	615.338	0.577	40	0		KCABLL
CCCSc1nc2c(ncn2[C@H]2O[C@@H](CO[P@](=O)([O-])O[P@](=O)([O-])C(F)(F)[P@@](=O)([O-])O)[C@H](O)[C@H]2O)c(N)n1	ZINC001529084368	1066288232	/nfs/dbraw/zinc/28/82/32/1066288232.db2.gz	ZQXUQOHLHUWLSA-CCQAIOMUSA-N	-3	2	615.338	0.577	40	0		KCABLL