PDB ligand accession: WMR
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: MPWCUTPIYOWTII-UHFFFAOYSA-N
SMILES: CCCCc1c2c(c3c(n[nH]c3n1)N)CC(SC2)(C)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrazolopyridines
- Subclass: None
- Class: Pyrazolopyridines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5ALK | Download | Experimental | e5alkA1 | alpha/beta-Hydrolases | LigPlot |