smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])C1=CC(N=Nc2ccc(S(=O)(=O)Nc3ccccn3)cc2)=CC(=NNc2ccc(S(=O)(=O)[N-]c3ccccn3)cc2)C1=O	ZINC000077273649	553657578	/nfs/dbraw/zinc/65/75/78/553657578.db2.gz	XUCGEVUEJYLZHM-XUXOKTBYSA-N	-2	2	658.678	5.157	10	10	in-vitro	KKCELL
Nc1ccc2cc(S(=O)(=O)[O-])c(N[NH+]=C3C=CC4=CC(S(=O)(=O)[O-])=C(N=Nc5ccc(N=Nc6ccc(N)c7cc(S(=O)(=O)[O-])ccc67)cc5)C(=O)C4=C3)c(O)c2c1	ZINC000232321405	572187798	/nfs/dbraw/zinc/18/77/98/572187798.db2.gz	XOJQUIDDFVRDCO-IUHJAEDGSA-N	-4	2	842.850	8.708	10	10		KKCELL
O=C1C=CC(=[NH+]Nc2cc(S(=O)(=O)[O-])cc3cc(S(=O)(=O)[O-])c(N=Nc4ccc([N+](=O)[O-])cc4)c(O)c32)C([O-])=C1N=Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000232321347	572187743	/nfs/dbraw/zinc/18/77/43/572187743.db2.gz	LGXQDISFLSBKEI-PKDJZJALSA-N	-3	2	754.628	7.218	10	10		KKCELL