PDB ligand accession: 3KG
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: YGKPLXQSJLTMCO-UHFFFAOYSA-N
SMILES: c1ccc(cc1)n2c(ccn2)C3=NN(C=CC3=O)c4cccc(c4)C(F)(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 |
---|---|---|---|---|---|
3WYK | Download | Experimental | e3wykA1 e3wykB1 | PDEase-like PDEase-like | LigPlot |