PDB ligand accession: IHM
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QEFVLMGONWRDJH-SANMLTNESA-N
SMILES: CC(=O)Nc1cccc(c1)c2ccn(n2)C(Cc3cc[n+](cc3)[O-])c4ccc(c(c4)OCC5CC5)OC(F)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 |
---|---|---|---|---|---|
3V9B | Download | Experimental | e3v9bA1 e3v9bB1 e3v9bC1 e3v9bD1 | PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |