smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@H](C[NH+]2CCOCC2)C1	ZINC000093017170	285159397	/nfs/dbraw/zinc/15/93/97/285159397.db2.gz	BQJGZBZXJNBOMS-BBOMDTFKSA-N	2	2	345.443	2.652	40	5		EFBBLP
O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H](C[NH+]2CCOCC2)C1	ZINC000093017170	285159399	/nfs/dbraw/zinc/15/93/99/285159399.db2.gz	BQJGZBZXJNBOMS-BBOMDTFKSA-N	2	2	345.443	2.652	40	5		EFBBLP
Cn1cc[nH+]c1C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1	ZINC000090003903	472579200	/nfs/dbraw/zinc/57/92/00/472579200.db2.gz	OIXKESJWSBWODS-CYBMUJFWSA-N	2	2	332.379	2.922	40	5		EFBBLP
Cn1cc[nH+]c1C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1	ZINC000090003903	472579204	/nfs/dbraw/zinc/57/92/04/472579204.db2.gz	OIXKESJWSBWODS-CYBMUJFWSA-N	2	2	332.379	2.922	40	5		EFBBLP
Cn1cc[nH+]c1C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1	ZINC000090003902	472579323	/nfs/dbraw/zinc/57/93/23/472579323.db2.gz	OIXKESJWSBWODS-ZDUSSCGKSA-N	2	2	332.379	2.922	40	5		EFBBLP
Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1	ZINC000090003902	472579326	/nfs/dbraw/zinc/57/93/26/472579326.db2.gz	OIXKESJWSBWODS-ZDUSSCGKSA-N	2	2	332.379	2.922	40	5		EFBBLP
O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H](C[NH+]2CCOCC2)C1	ZINC000093017168	473028734	/nfs/dbraw/zinc/02/87/34/473028734.db2.gz	BQJGZBZXJNBOMS-PFWMLDTASA-N	2	2	345.443	2.652	40	5		EFBBLP
O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H](C[NH+]2CCOCC2)C1	ZINC000093017168	473028739	/nfs/dbraw/zinc/02/87/39/473028739.db2.gz	BQJGZBZXJNBOMS-PFWMLDTASA-N	2	2	345.443	2.652	40	5		EFBBLP