PDB ligand accession: KP6
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QESMYIFDOLAREQ-UHFFFAOYSA-N
SMILES: Cc1c(c(n(n1)C)C)CCO
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 |
---|---|---|---|---|---|
5CGA | Download | Experimental | e5cgaA1 e5cgaB1 e5cgaB1 e5cgaC1 e5cgaA1 e5cgaC1 e5cgaE1 e5cgaF1 e5cgaF1 e5cgaH1 e5cgaE1 e5cgaH1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |