PDB ligand accession: 7CP
DrugBank: DB07242
PubChem:
ChEMBL: n/a
InChI Key: XGUIMGJMQKZRGM-LLVKDONJSA-N
SMILES: [H][C@@]1(C#N)C2=C(N(C)C3=C(Cl)C(Cl)=CC=C23)C(=O)NC11CCN(C)CC1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
THR | 180 | Phosphorylation | PyMOL_Chai1 |