PDB ligand accession: HA3
DrugBank: DB07879
PubChem:
ChEMBL: n/a
InChI Key: SMSIXMLQOONOQQ-UHFFFAOYSA-N
SMILES: c1ccc(cc1)c2cnc3n2CCN(C3)C(=O)c4ccc(s4)C(=O)NO
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Imidazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2VQM | Download | Experimental | e2vqmA1 | HAD domain-related | LigPlot |
2VQV | Download | Experimental | e2vqvA1 e2vqvB1 | HAD domain-related HAD domain-related | LigPlot |