PDB ligand accession: S8Z
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: DOQWIXXNZSOWDD-HSZRJFAPSA-N
SMILES: COCC#Cc1cccc(c1)C2(C3=NCC(CN3C(=N2)N)(F)F)c4ccc(cc4)OC(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Diphenylmethanes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4ACX | Download | Experimental | e4acxA2 | cradle loop barrel | LigPlot |