molecule_chembl_id | structure | assay_type | relation | values | units | mol_wt | smiles | organism | assay_chembl_id | bao_label |
---|---|---|---|---|---|---|---|---|---|---|
CHEMBL4444007 | Ki | = | 1000.0 | nM | 309.39 | COCCNC(=N)NCCC[C@H](N)C(=O)NS(C)(=O)=O | Homo sapiens | CHEMBL4380142 | cell-based format |