smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)COC[C@@H](O)C[NH2+][C@H](Cc1ccccc1)c1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000036154888	568964760	/nfs/dbraw/zinc/96/47/60/568964760.db2.gz	OXNPJKVQNGONHY-LEWJYISDSA-N	1	1	440.500	3.552	10	5		IHBEMO
CC(C)COC[C@H](O)C[NH2+][C@@H](Cc1ccccc1)c1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000036154878	568964727	/nfs/dbraw/zinc/96/47/27/568964727.db2.gz	OXNPJKVQNGONHY-RTWAWAEBSA-N	1	1	440.500	3.552	10	5		IHBEMO
CC(C)COC[C@H](O)C[NH2+][C@H](Cc1ccccc1)c1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000036154885	568964633	/nfs/dbraw/zinc/96/46/33/568964633.db2.gz	OXNPJKVQNGONHY-NHCUHLMSSA-N	1	1	440.500	3.552	10	5		IHBEMO
CC(C)COC[C@@H](O)C[NH2+][C@@H](Cc1ccccc1)c1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000036154882	568964706	/nfs/dbraw/zinc/96/47/06/568964706.db2.gz	OXNPJKVQNGONHY-SFTDATJTSA-N	1	1	440.500	3.552	10	5		IHBEMO