smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)=CCc1cc([C@@H]2CC(=O)c3c(O)cc([O-])cc3O2)c(CC=C(C)C)c(O)c1O	ZINC000000689691	291287333	/nfs/dbraw/zinc/28/73/33/291287333.db2.gz	BVHLNRAYBCPKOY-NRFANRHFSA-N	-1	1	424.493	5.233	10	10	biogenic,in-vivo	HKCEMM
CC(C)=CCc1cc([C@H]2CC(=O)c3c(O)cc([O-])cc3O2)c(CC=C(C)C)c(O)c1O	ZINC000002008843	291287606	/nfs/dbraw/zinc/28/76/06/291287606.db2.gz	BVHLNRAYBCPKOY-OAQYLSRUSA-N	-1	1	424.493	5.233	10	10	biogenic	HKCEMM
CC(C)=CCC/C(C)=C/Cc1c([O-])cc2c(c1O)C(=O)C[C@@H](c1ccc(O)c(O)c1)O2	ZINC000015122022	291284278	/nfs/dbraw/zinc/28/42/78/291284278.db2.gz	XCYSQFHYFNWYFP-CEMXSPGASA-N	-1	1	424.493	5.451	10	10	biogenic,in-vitro	HKCEMM