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=C2C(=O)[N-]C(=O)N(c3ccccc3)C2=O)c(Br)c(Br)c1[O-]	ZINC000016194696	521960019	/nfs/dbraw/zinc/96/00/19/521960019.db2.gz	ZWFIMXWOBSEVGL-XFFZJAGNSA-N	-2	1	496.111	4.433	10	10		JICEML
Cc1cc(C=C2C(=O)NC(=S)N(c3ccccc3)C2=O)c(C)n1-c1cc(C(=O)[O-])cc(C(=O)[O-])c1	ZINC000033420136	526091867	/nfs/dbraw/zinc/09/18/67/526091867.db2.gz	JQIGYUULGQKILM-NDENLUEZSA-N	-2	1	489.509	4.162	10	10		JICEML
CCN(CC)c1ccc(N=Nc2cc(S(=O)(=O)[O-])cc3cc(S(=O)(=O)[O-])cc([O-])c32)c(O)c1	ZINC000100388288	569758568	/nfs/dbraw/zinc/75/85/68/569758568.db2.gz	LDQGUZFHJKOWGX-DQRAZIAOSA-N	-3	1	495.535	4.006	10	10		JICEML