PDB ligand accession: I5D
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ZTYHZMAZUWOXNC-UHFFFAOYSA-N
SMILES: c1cc(ccc1c2c(c(nc(c2C#N)SCC(=O)N)N)C#N)OCC3CC3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
8HDO | Download | Experimental | e8hdoR1 | Family A G protein-coupled receptor-like | LigPlot |