PDB ligand accession: JBO
DrugBank: DB11518
PubChem:
ChEMBL:
InChI Key: NOOCSNJCXJYGPE-UHFFFAOYSA-N
SMILES: Cc1c(cccc1Nc2c(cccn2)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 |
---|---|---|---|---|---|
7ERD | Download | Experimental | e7erdA1 e7erdA1 e7erdB1 | Rossmann-like Rossmann-like Rossmann-like | LigPlot |