PDB ligand accession: ZRO
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: DDORHAWNAXTQBY-UHFFFAOYSA-N
SMILES: c1cc(ccc1CCC2=C(NC(=O)NC2=O)C(=O)O)C(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Trifluoromethylbenzenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3W2M | Download | Experimental | e3w2mA1 e3w2mB1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |