PDB ligand accession: C83
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: JWJQXZNLFNMIHE-AHRODOEDSA-N
SMILES: CC1C(C(N=C(S1)N)(C)c2cc(ccc2F)NC(=O)c3cnc(cn3)OCF)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Anilides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6JT3 | Download | Experimental | e6jt3A1 e6jt3A2 | cradle loop barrel cradle loop barrel | LigPlot |