smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cccc2[nH+]c(-c3ccc([N+](=O)[O-])cc3)c(NC3CCCCC3)n21	ZINC000013564913	206303492	/nfs/dbraw/zinc/30/34/92/206303492.db2.gz	KHTJCEBCFXRLEG-UHFFFAOYSA-N	1	1	350.422	4.963	40	5		FJBBMO
C[C@@H](C(=O)c1ccc2cc(Br)c3ccccc3c2c1)[NH+](C)C	ZINC000006486967	204250083	/nfs/dbraw/zinc/25/00/83/204250083.db2.gz	WLGYGMHEMOYARN-LBPRGKRZSA-N	1	1	356.263	4.888	40	5		FJBBMO
Cc1cccc(N(CC(=O)c2cccc([N+](=O)[O-])c2)C2=[NH+]CCCCC2)c1	ZINC000008414594	210097995	/nfs/dbraw/zinc/09/79/95/210097995.db2.gz	QTQNMNBKPHOUDH-UHFFFAOYSA-N	1	1	365.433	4.565	40	5		FJBBMO
C[C@H](C(=O)c1ccc2cc(Br)c3ccccc3c2c1)[NH+](C)C	ZINC000001593471	204013818	/nfs/dbraw/zinc/01/38/18/204013818.db2.gz	WLGYGMHEMOYARN-GFCCVEGCSA-N	1	1	356.263	4.888	40	5		FJBBMO
Cc1ccc(N(CC(=O)c2ccc([N+](=O)[O-])cc2)C2=[NH+]CCCCC2)cc1	ZINC000008411732	210097879	/nfs/dbraw/zinc/09/78/79/210097879.db2.gz	VDVCJPAVFLHICI-UHFFFAOYSA-N	1	1	365.433	4.565	40	5		FJBBMO
Cc1ccc2[nH+]c(-c3ccc([N+](=O)[O-])cc3)c(NC3CCCCC3)n2c1	ZINC000013564914	571108018	/nfs/dbraw/zinc/10/80/18/571108018.db2.gz	GVFAVXZTDKXHJS-UHFFFAOYSA-N	1	1	350.422	4.963	40	5		FJBBMO