PDB ligand accession: AV9
DrugBank: DB11800
InChI Key: SPMVMDHWKHCIDT-UHFFFAOYSA-N
SMILES: CC1=CC(=NC(=O)Nc2ccc(cc2Cl)Oc3ccnc4c3cc(c(c4)OC)OC)NO1
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Ethers
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P35916 | Download | Predicted | P35916_F1_nD7 | Immunoglobulin-like beta-sandwich |
4BSJ | Predicted | e4bsjA4 e4bsjA3 | ||
4BSK | Predicted | e4bskA4 e4bskA3 |