smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cc([N+](=O)[O-])c([O-])cc3[O-])c(=O)n2[C@H]1c1ccccc1OC(C)C	ZINC000408830609	1059575951	/nfs/dbraw/zinc/57/59/51/1059575951.db2.gz	PROJQWOMGAROLK-KIHONOKQSA-N	-2	1	539.566	2.905	40	5		KFBBML
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cc([N+](=O)[O-])c([O-])cc3[O-])c(=O)n2[C@@H]1c1ccccc1OC(C)C	ZINC000408830628	1059575800	/nfs/dbraw/zinc/57/58/00/1059575800.db2.gz	PROJQWOMGAROLK-YLVTVWEBSA-N	-2	1	539.566	2.905	40	5		KFBBML
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cc([N+](=O)[O-])c([O-])cc3[O-])c(=O)n2[C@@H]1c1ccc(OC(C)C)c(OC)c1	ZINC000409036426	1059032086	/nfs/dbraw/zinc/03/20/86/1059032086.db2.gz	RHGHEKQFQJDARQ-QJWUKVPRSA-N	-2	1	569.592	2.914	40	5		KFBBML
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cc([N+](=O)[O-])c([O-])cc3[O-])c(=O)n2[C@H]1c1ccc(OC(C)C)c(OC)c1	ZINC000409036437	1059647623	/nfs/dbraw/zinc/64/76/23/1059647623.db2.gz	RHGHEKQFQJDARQ-ZYDFGXJWSA-N	-2	1	569.592	2.914	40	5		KFBBML
CCOC(=O)COc1c(I)cc(C=Cc2nc([O-])c([N+](=O)[O-])c(=O)[n-]2)cc1OC	ZINC000409335406	1059725799	/nfs/dbraw/zinc/72/57/99/1059725799.db2.gz	ZQWLKURAIRKCOK-PLNGDYQASA-N	-2	1	517.232	2.522	40	5		KFBBML
CCOc1cc(C=Cc2nc([O-])c([N+](=O)[O-])c(=O)[n-]2)cc(I)c1OCC(=O)OC	ZINC000409338176	1059727688	/nfs/dbraw/zinc/72/76/88/1059727688.db2.gz	FHTMUBPIPWVZDR-PLNGDYQASA-N	-2	1	517.232	2.522	40	5		KFBBML