PDB ligand accession: LGB
DrugBank: DB08088
PubChem: n/a
ChEMBL:
InChI Key: KALFKWQLCWAXJO-RNSKTZJQSA-N
SMILES: Cc1c(ccc(c1Cl)C#N)N=C2N3CCC(C3C(O2)C(F)(F)F)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzonitriles
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3G0W | Download | Experimental | e3g0wA1 | Nuclear receptor ligand-binding domain | LigPlot |