PDB ligand accession: 3AC
DrugBank: DB07035
PubChem:
ChEMBL: n/a
InChI Key: XMFUXIRAVPMVRS-FNORWQNLSA-N
SMILES: CCC1=C(NC(=O)C(=C1Oc2cccc(c2)C=CC#N)I)C
Drug action: n/a
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 | LigPlot |
---|---|---|---|---|---|
2B5J | Download | Experimental | e2b5jA5 e2b5jA7 | Ribonuclease H-like Alpha-beta plaits | LigPlot |