PDB ligand accession: H3R
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: QHRSESMSOJZMCO-UHFFFAOYSA-N
SMILES: Cc1cc([nH]n1)c2ccccc2
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Pyrazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4BDF | Download | Experimental | e4bdfA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |