PDB ligand accession: 29B
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: UCYCFYFNBWRJIL-UHFFFAOYSA-N
SMILES: c1cc(ccc1c2c[nH]nc2c3ccncc3)F
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 |
---|---|---|---|---|---|
3ROC | Download | Experimental | e3rocA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |