smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC(=O)COc1c(Cl)cc(/C=C2/C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OC	ZINC000059396376	195398610	/nfs/dbraw/zinc/39/86/10/195398610.db2.gz	KZOJEEDNQZAXNW-AUWJEWJLSA-N	0	2	479.272	3.220	10	10		JGCELN
O=C(Nc1ccccc1NC=C1C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O)C(F)(F)F	ZINC000016450223	527424162	/nfs/dbraw/zinc/42/41/62/527424162.db2.gz	HVZVFLIUQOEIIK-FMIVXFBMSA-N	0	2	452.776	3.420	10	10		JGCELN
Nc1ccc(NC(=O)c2cc(I)cc(I)c2O)cc1	ZINC000040411904	563140892	/nfs/dbraw/zinc/14/08/92/563140892.db2.gz	NSQZXFXJSYSVBG-UHFFFAOYSA-N	0	2	480.043	3.436	10	10		JGCELN
CCOC(=O)c1ccc(N2NC(=O)/C(=C\c3cc(Cl)cc(Br)c3O)C2=O)cc1	ZINC000001191973	194065954	/nfs/dbraw/zinc/06/59/54/194065954.db2.gz	XAVLFTXWTXEZPS-RIYZIHGNSA-N	0	2	465.687	3.446	10	10		JGCELN