PDB ligand accession: QX1
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ZVVQDNWRXSSQDL-UHFFFAOYSA-N
SMILES: CN1CCC(CC1)Nc2c(c(n3c(n2)c(cn3)c4ccc(c(c4)OC)OC)N)c5ccccc5
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 |
---|---|---|---|---|---|
6VHG | Download | Experimental | e6vhgA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |