PDB ligand accession: X03
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: YAHBQFQHOVVECT-MRVPVSSYSA-N
SMILES: CCC(C)(C)C1CCc2c(c(n[nH]2)C(=O)NN)C1
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 |
---|---|---|---|---|---|
3QQL | Download | Experimental | e3qqlA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |