smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1sc2nc3c([O-])cc(=S)[n-]c3c(Br)c2c1C	ZINC000005687140	564032947	/nfs/dbraw/zinc/03/29/47/564032947.db2.gz	VCWJFOHGVGONOM-UHFFFAOYSA-N	-2	3	341.255	4.592	40	0		EJABHL
S=C(Sc1nc2ccccc2[n-]1)Sc1nc2ccccc2[n-]1	ZINC000001673362	564099043	/nfs/dbraw/zinc/09/90/43/564099043.db2.gz	INBINYFHGYLEGH-UHFFFAOYSA-N	-2	3	342.474	4.609	40	0		EJABHL
Cc1cc(Cl)cc(C(=O)CCCCCCCCC(=O)[O-])c1[O-]	ZINC000006188939	563560659	/nfs/dbraw/zinc/56/06/59/563560659.db2.gz	GEXMCFGFVVWQHS-UHFFFAOYSA-N	-2	3	326.820	4.742	40	0		EJABHL
O=c1oc2cc([O-])ccc2c(-c2ccccc2)c1-c1ccc([O-])cc1	ZINC000071404996	215769195	/nfs/dbraw/zinc/76/91/95/215769195.db2.gz	MLAIPUZEKYJFIL-UHFFFAOYSA-N	-2	3	330.339	4.538	40	0		EJABHL