PDB ligand accession: 1LF
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: BUWQYHYHSQTERY-UHFFFAOYSA-N
SMILES: Cc1nc(nc(n1)N2CCC(CC2)C(=O)NCc3ccccc3C(F)(F)F)NC
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 |
---|---|---|---|---|---|
4JNC | Download | Experimental | e4jncA1 | alpha/beta-Hydrolases | LigPlot |