PDB ligand accession: 0JP
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: GFIAXSKRRKHJBD-UHFFFAOYSA-N
SMILES: COc1cc2c(cc1OC)-c3c(ncn3CC2)c4cncs4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: Anisoles
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4DFF | Download | Experimental | e4dffB1 | PDEase-like | LigPlot |