smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCc1cc(C[C@@H](NC(C)=O)C(=O)NCCCCOc2cccc(O)c2[N+](=O)[O-])ccc1N(C(=O)C(=O)[O-])c1ccccc1C(=O)[O-]	ZINC000027096309	561837973	/nfs/dbraw/zinc/83/79/73/561837973.db2.gz	CZHXFEWAZCRHGB-HSZRJFAPSA-N	-2	2	650.641	3.333	1	5		KGBFLL
CCc1cc(C[C@H](NC(C)=O)C(=O)NCCCCOc2cccc(O)c2[N+](=O)[O-])ccc1N(C(=O)C(=O)[O-])c1ccccc1C(=O)[O-]	ZINC000027096319	561837945	/nfs/dbraw/zinc/83/79/45/561837945.db2.gz	CZHXFEWAZCRHGB-QHCPKHFHSA-N	-2	2	650.641	3.333	1	5		KGBFLL
COc1cc([N+](=O)[O-])c(OC)c2c(Nc3ccc(S(=O)(=O)[O-])c4cc(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c34)cc(C)[nH+]c12	ZINC000082174932	562741594	/nfs/dbraw/zinc/74/15/94/562741594.db2.gz	LFUCQORKIXFSKP-UHFFFAOYSA-N	-2	2	629.603	3.106	1	5		KGBFLL