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)C[C@H](c1c(Cc2ccc3c(c2)CCC(C)(C)O3)[n-][nH]c1=O)c1cc2ccc(OC)cc2[nH]c1=O	ZINC000217626811	571601975	/nfs/dbraw/zinc/60/19/75/571601975.db2.gz	FKKUEOJHYGQAKH-FQEVSTJZSA-N	-1	1	517.582	3.943	50	70		KHIAMM
COC(=O)C[C@@H](c1c(Cc2ccc3c(c2)CCC(C)(C)O3)[n-][nH]c1=O)c1cc2ccc(OC)cc2[nH]c1=O	ZINC000217626902	571602097	/nfs/dbraw/zinc/60/20/97/571602097.db2.gz	FKKUEOJHYGQAKH-HXUWFJFHSA-N	-1	1	517.582	3.943	50	70		KHIAMM
COc1ccc(-c2cc([O-])c3c(=O)cc4c(c-3o2)[C@@H](c2cc3cc5c(cc3[nH]c2=O)OCO5)CC(=O)O4)cc1O	ZINC000217756533	571602556	/nfs/dbraw/zinc/60/25/56/571602556.db2.gz	ARQPOOFTSUIAGN-CQSZACIVSA-N	-1	1	541.468	3.891	50	70		KHIAMM
COc1ccc(-c2cc([O-])c3c(=O)cc4c(c-3o2)[C@H](c2cc3cc5c(cc3[nH]c2=O)OCO5)CC(=O)O4)cc1O	ZINC000217756620	571602525	/nfs/dbraw/zinc/60/25/25/571602525.db2.gz	ARQPOOFTSUIAGN-AWEZNQCLSA-N	-1	1	541.468	3.891	50	70		KHIAMM