smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2N2CC[NH2+]CC2)CC1	ZINC000004182315	484028037	/nfs/dbraw/zinc/02/80/37/484028037.db2.gz	IVPRYHSZZKSBPM-UHFFFAOYSA-N	1	0	369.447	-0.060	50	5		FBBARO
C[N@@H+]1CCN2c3ccc([N+](=O)[O-])cc3CC3(C(=O)NC(=O)NC3=O)[C@@H]2C1	ZINC000016993809	484011992	/nfs/dbraw/zinc/01/19/92/484011992.db2.gz	GVWUKQWJJQFUGC-LBPRGKRZSA-N	1	0	359.342	-0.376	50	5		FBBARO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+](CCO)CCN2CCOCC2)c1	ZINC000072314199	483653051	/nfs/dbraw/zinc/65/30/51/483653051.db2.gz	OWNQHYYFJVRFEI-MRXNPFEDSA-N	1	0	369.418	-0.039	50	5		FBBARO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+](CCO)CCN2CCOCC2)c1	ZINC000072314200	483653074	/nfs/dbraw/zinc/65/30/74/483653074.db2.gz	OWNQHYYFJVRFEI-INIZCTEOSA-N	1	0	369.418	-0.039	50	5		FBBARO