smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
NC(=O)c1ccc2c3ccc(C(=O)[O-])c4c(C(=O)[O-])ccc(c5ccc(C(N)=O)c1c25)c34	ZINC000071622017	568782992	/nfs/dbraw/zinc/78/29/92/568782992.db2.gz	PONZBUKBFVIXOD-UHFFFAOYSA-N	-2	0	426.384	4.900	40	5		IJBBRL
O=c1[n-]c(C=Cc2ccc(OCc3ccc(Cl)cc3Cl)cc2)nc([O-])c1[N+](=O)[O-]	ZINC000409339227	556637273	/nfs/dbraw/zinc/63/72/73/556637273.db2.gz	SYBDXTHELDHRQR-BAQGIRSFSA-N	-2	0	434.235	4.852	40	5		IJBBRL
O=C([O-])c1ccc2c3ccc(C(=O)[O-])c4c(C(=O)[O-])ccc(c5ccc(C(=O)[O-])c1c25)c34	ZINC000001575617	555703952	/nfs/dbraw/zinc/70/39/52/555703952.db2.gz	FVDOBFPYBSDRKH-UHFFFAOYSA-N	-4	0	428.352	4.530	40	5		IJBBRL
CCOc1cc(C=Cc2nc([O-])c([N+](=O)[O-])c(=O)[n-]2)ccc1OCc1ccccc1Cl	ZINC000409331000	557065284	/nfs/dbraw/zinc/06/52/84/557065284.db2.gz	NXFXMEUFQHAIJG-NTMALXAHSA-N	-2	0	443.843	4.598	40	5		IJBBRL
CCOc1cc(C=Cc2nc([O-])c([N+](=O)[O-])c(=O)[n-]2)ccc1OCc1ccc(Cl)cc1	ZINC000409330687	557064945	/nfs/dbraw/zinc/06/49/45/557064945.db2.gz	LZWMTEVHYBIODA-POHAHGRESA-N	-2	0	443.843	4.598	40	5		IJBBRL