PDB ligand accession: BMU
DrugBank: DB02277
PubChem:
ChEMBL:
InChI Key: FWIJKWMXNHRSRO-UHFFFAOYSA-N
SMILES: CC(C)(C)c1cc(n(n1)C)NC(=O)Nc2ccc(cc2)Cl
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: N-phenylureas
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
# | DrugDomain Data | UniProt Accession | Drug Action | Affinity data |
---|---|---|---|---|
1 | Q16539_BMU | Q16539 | n/a | IC50(nM) = 794.0 Kd(nM) = 1160.0 kon(M-1-s-1) = 118000.0 koff(s-1) = 0.14 |