smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1nc(N2Cc3n[nH]c(=O)n3C[C@@H]2C(=O)[O-])ncc1[N+](=O)[O-]	ZINC000263082961	262494840	/nfs/dbraw/zinc/49/48/40/262494840.db2.gz	RWLIOUYDMLOUFY-RXMQYKEDSA-N	-1	0	322.241	-1.675	10	5		DABERM
Nc1nc(N2Cc3n[nH]c(=O)n3C[C@H]2C(=O)[O-])ncc1[N+](=O)[O-]	ZINC000263082963	263324876	/nfs/dbraw/zinc/32/48/76/263324876.db2.gz	RWLIOUYDMLOUFY-YFKPBYRVSA-N	-1	0	322.241	-1.675	10	5		DABERM
O=C([O-])[C@@H]1O[C@H](Oc2ccc([N+](=O)[O-])cc2)[C@@H](O)[C@@H](O)[C@@H]1O	ZINC000072099143	191035434	/nfs/dbraw/zinc/03/54/34/191035434.db2.gz	QSUILVWOWLUOEU-GBVMLCMLSA-N	-1	0	315.234	-1.134	10	5		DABERM
O=C([O-])[C@@H]1O[C@@H](Oc2ccccc2[N+](=O)[O-])[C@@H](O)[C@H](O)[C@H]1O	ZINC000253616807	373636212	/nfs/dbraw/zinc/63/62/12/373636212.db2.gz	UADVJQJTJSOJOQ-WSOSLHDDSA-N	-1	0	315.234	-1.134	10	5		DABERM
O=C([O-])[C@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@H](O)[C@@H]1O	ZINC000013526571	372803910	/nfs/dbraw/zinc/80/39/10/372803910.db2.gz	QSUILVWOWLUOEU-RACFRTOFSA-N	-1	0	315.234	-1.134	10	5		DABERM