smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H]([NH2+]Cc1ccco1)c1ccccc1[N+](=O)[O-]	ZINC000020525876	371288584	/nfs/dbraw/zinc/28/85/84/371288584.db2.gz	XUTAEUMDWZHGRP-SNVBAGLBSA-N	1	1	246.266	3.039	10	5		BGBEMO
C[C@H]([NH2+]Cc1ccco1)c1ccccc1[N+](=O)[O-]	ZINC000020525877	388774606	/nfs/dbraw/zinc/77/46/06/388774606.db2.gz	XUTAEUMDWZHGRP-JTQLQIEISA-N	1	1	246.266	3.039	10	5		BGBEMO
C[NH+](C)/C=C\c1ccc2ccccc2c1[N+](=O)[O-]	ZINC000033337051	172351916	/nfs/dbraw/zinc/35/19/16/172351916.db2.gz	ADLFDROCPXPTRU-KTKRTIGZSA-N	1	1	242.278	3.280	10	5		BGBEMO
CC(C)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000036964881	187258977	/nfs/dbraw/zinc/25/89/77/187258977.db2.gz	PNHLTZPUAQDDFQ-UHFFFAOYSA-N	1	1	242.706	3.088	10	5		BGBEMO
CCC(CC)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1	ZINC000039020266	347175027	/nfs/dbraw/zinc/17/50/27/347175027.db2.gz	UJEYTQRRPXIGTC-UHFFFAOYSA-N	1	1	236.315	3.215	10	5		BGBEMO
C[C@H]([NH2+]Cc1ccoc1)c1ccccc1[N+](=O)[O-]	ZINC000135458176	592013458	/nfs/dbraw/zinc/01/34/58/592013458.db2.gz	AGLAPICEMHRQNE-JTQLQIEISA-N	1	1	246.266	3.039	10	5		BGBEMO
C[C@@H]([NH2+]Cc1ccoc1)c1ccccc1[N+](=O)[O-]	ZINC000135458198	582753910	/nfs/dbraw/zinc/75/39/10/582753910.db2.gz	AGLAPICEMHRQNE-SNVBAGLBSA-N	1	1	246.266	3.039	10	5		BGBEMO
Cc1cc(/C=C/[NH+]2CCCC2)c([N+](=O)[O-])cc1C	ZINC000220546479	350176570	/nfs/dbraw/zinc/17/65/70/350176570.db2.gz	OONPOLOSTNVSHU-VMPITWQZSA-N	1	1	246.310	3.278	10	5		BGBEMO