smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(NCCC[NH+](C)C)c2cc3ccc4cccc5ccc(c2n1)c3c45	ZINC000001573592	570502116	/nfs/dbraw/zinc/50/21/16/570502116.db2.gz	UFACKJKXGIGNDW-UHFFFAOYSA-N	1	1	367.496	5.804	40	5		FKBBMO
O[C@H](C[N@H+]1CCC[C@H]2CCCC[C@@H]21)c1cc2ccccc2c2ccccc21	ZINC000004783039	570606515	/nfs/dbraw/zinc/60/65/15/570606515.db2.gz	HSYCCRRCCGGXCB-AYCKEJKLSA-N	1	1	359.513	5.681	40	5		FKBBMO
O[C@@H](C[N@H+]1CCC[C@H]2CCCC[C@@H]21)c1cc2ccccc2c2ccccc21	ZINC000004783040	207047653	/nfs/dbraw/zinc/04/76/53/207047653.db2.gz	HSYCCRRCCGGXCB-YWWLGCSWSA-N	1	1	359.513	5.681	40	5		FKBBMO
Nc1ccc2c(c1)[nH+]c1ccccc1c2SCc1ccc([N+](=O)[O-])cc1	ZINC000005594112	570631632	/nfs/dbraw/zinc/63/16/32/570631632.db2.gz	AVIAVVISMHVVAC-UHFFFAOYSA-N	1	1	361.426	5.171	40	5		FKBBMO
Cc1[nH]c2ccccc2c1[C@@H](Nc1cc(C)cc[nH+]1)c1cccc([N+](=O)[O-])c1	ZINC000005753053	207115177	/nfs/dbraw/zinc/11/51/77/207115177.db2.gz	MZNGPHFJIPXOND-QFIPXVFZSA-N	1	1	372.428	5.289	40	5		FKBBMO
Cc1[nH]c2ccccc2c1[C@H](Nc1cc(C)cc[nH+]1)c1cccc([N+](=O)[O-])c1	ZINC000005753057	204224983	/nfs/dbraw/zinc/22/49/83/204224983.db2.gz	MZNGPHFJIPXOND-JOCHJYFZSA-N	1	1	372.428	5.289	40	5		FKBBMO