smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc([C@@H]([NH3+])C[NH3+])cc1[N+](=O)[O-]	ZINC000072200784	343069584	/nfs/dbraw/zinc/06/95/84/343069584.db2.gz	FMZQURVEPYDXIB-ZETCQYMHSA-N	2	2	211.221	0.562	10	5		BCBELP
COc1cc([C@@H]([NH3+])C[NH3+])cc([N+](=O)[O-])c1O	ZINC000072201198	343069579	/nfs/dbraw/zinc/06/95/79/343069579.db2.gz	WZIGZLJTLRVURI-LURJTMIESA-N	2	2	227.220	0.268	10	5		BCBELP
COc1cc([C@H]([NH3+])C[NH3+])cc([N+](=O)[O-])c1O	ZINC000072201197	343069621	/nfs/dbraw/zinc/06/96/21/343069621.db2.gz	WZIGZLJTLRVURI-ZCFIWIBFSA-N	2	2	227.220	0.268	10	5		BCBELP
COc1ccc([C@H]([NH3+])C[NH3+])cc1[N+](=O)[O-]	ZINC000072200783	343069791	/nfs/dbraw/zinc/06/97/91/343069791.db2.gz	FMZQURVEPYDXIB-SSDOTTSWSA-N	2	2	211.221	0.562	10	5		BCBELP
CCN(CC)C(=O)CC[NH2+][N+](C)(C)C	ZINC000039190600	717126483	/nfs/dbraw/zinc/12/64/83/717126483.db2.gz	NKGRDRUVKCSSQI-UHFFFAOYSA-N	2	2	202.322	0.456	10	5		BCBELP
[NH3+]C[C@@H]([NH3+])c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000072201147	343069475	/nfs/dbraw/zinc/06/94/75/343069475.db2.gz	TTXWUGNAANUIHK-ZCFIWIBFSA-N	2	2	225.204	0.282	10	5		BCBELP
[NH3+]C[C@H]([NH3+])c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000072201148	343069654	/nfs/dbraw/zinc/06/96/54/343069654.db2.gz	TTXWUGNAANUIHK-LURJTMIESA-N	2	2	225.204	0.282	10	5		BCBELP