PDB ligand accession: DWB
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: WIRKEQRUHLXVOQ-QFIPXVFZSA-N
SMILES: COc1ccc2c(c1)C3(COC(=N3)N)c4cc(ccc4O2)c5cc(ccc5F)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrans
- Subclass: 1-benzopyrans
- Class: Benzopyrans
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4FRJ | Download | Experimental | e4frjA2 e4frjA3 | cradle loop barrel cradle loop barrel | LigPlot |