PDB ligand accession: Z72
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: YUTTWVBLGONANE-UHFFFAOYSA-N
SMILES: COc1ccc2c(c1OC3CCCC3)OC(=O)C=C2Nc4c(cncc4Cl)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Coumarins and derivatives
- Subclass: None
- Class: Coumarins and derivatives
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3LY2 | Download | Experimental | e3ly2A1 e3ly2B1 e3ly2C1 e3ly2D1 e3ly2E1 e3ly2F1 e3ly2G1 e3ly2H1 | PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |