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(Nc1nc2cc(CN3CCCCC3)ccc2n1-c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000038400974	563134260	/nfs/dbraw/zinc/13/42/60/563134260.db2.gz	IEOZVBDPTHRYGK-UHFFFAOYSA-N	0	3	455.518	5.172	10	5	in-vitro	JKBEHN
CC(C)N(C(C)C)P(O[C@H](C)c1ccccc1[N+](=O)[O-])O[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000022052391	555866345	/nfs/dbraw/zinc/86/63/45/555866345.db2.gz	NHOJISHKGBWJKJ-NUXNOFKDSA-N	0	3	463.471	6.704	10	5	in-vitro	JKBEHN
CC(C)N(C(C)C)P(O[C@@H](C)c1ccccc1[N+](=O)[O-])O[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000022052386	555866352	/nfs/dbraw/zinc/86/63/52/555866352.db2.gz	NHOJISHKGBWJKJ-ROUUACIJSA-N	0	3	463.471	6.704	10	5	in-vitro	JKBEHN
O=C(OCCN1CCCCCC1)C1(Cc2ccc([N+](=O)[O-])cc2)c2ccccc2-c2ccccc21	ZINC000013864179	563003843	/nfs/dbraw/zinc/00/38/43/563003843.db2.gz	DEZGOPRIDWWAEB-UHFFFAOYSA-N	0	3	470.569	5.523	10	5		JKBEHN
CC(C)N(C(C)C)P(O[C@H](C)c1ccccc1[N+](=O)[O-])O[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000022052399	555866325	/nfs/dbraw/zinc/86/63/25/555866325.db2.gz	NHOJISHKGBWJKJ-QZTJIDSGSA-N	0	3	463.471	6.704	10	5	in-vitro	JKBEHN