smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc(C=C2SC(=O)[N-]C2=O)ccc1Oc1ccccc1[N+](=O)[O-]	ZINC000066075256	205363092	/nfs/dbraw/zinc/36/30/92/205363092.db2.gz	CRTRBRWOZKROSF-DHDCSXOGSA-N	-1	1	372.358	3.720	1	5		FHBFMM
CN1c2ccc(Br)c3c([O-])c4ccccc4c(c23)C(=N)C1=O	ZINC000004031277	132386209	/nfs/dbraw/zinc/38/62/09/132386209.db2.gz	CTKYVOOOLVPRSI-UHFFFAOYSA-N	-1	1	355.191	3.805	1	5		FHBFMM
COc1c([O-])c(OC)c2oc3cccc(O)c3c(=O)c2c1CC=C(C)C	ZINC000014763098	560225822	/nfs/dbraw/zinc/22/58/22/560225822.db2.gz	AIBPYVNEBSHOCZ-UHFFFAOYSA-N	-1	1	356.374	3.883	1	5	in-vitro	FHBFMM
CN(C)c1ccc(NC(=O)c2c[n-]c3c4ccccc4ccc3c2=O)cc1	ZINC000040955208	208275824	/nfs/dbraw/zinc/27/58/24/208275824.db2.gz	CWMZJCHELOYDSG-UHFFFAOYSA-N	-1	1	357.413	4.000	1	5		FHBFMM
CCCCC1CC(=O)C(=C([O-])c2ccc(Cl)cc2[N+](=O)[O-])C(=O)C1	ZINC000103273303	222330827	/nfs/dbraw/zinc/33/08/27/222330827.db2.gz	APDDTIGUKSINCH-UHFFFAOYSA-N	-1	1	351.786	3.786	1	5		FHBFMM