smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1NC(=O)C(=CNNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)C(=O)N1	ZINC000059490009	568708217	/nfs/dbraw/zinc/70/82/17/568708217.db2.gz	QKIYBGIGFSMLAC-UHFFFAOYSA-N	0	2	424.395	-0.454	40	10		HBCBLN
CCOc1ccc(N2C(=O)NC(=O)C(=CNC34CN5CN(CN(C5)C3)C4)C2=O)cc1	ZINC000408533097	557316230	/nfs/dbraw/zinc/31/62/30/557316230.db2.gz	OCLKAIKRPKOAQW-FRKPEAEDSA-N	0	2	412.450	-0.300	40	10		HBCBLN
O=C1NC(=O)N(c2ccccc2Cl)C(=O)C1=CNC12CN3CN(CN(C3)C1)C2	ZINC000408533829	557318186	/nfs/dbraw/zinc/31/81/86/557318186.db2.gz	PGLINYWAUXURGB-LFYBBSHMSA-N	0	2	402.842	-0.046	40	10		HBCBLN