PDB ligand accession: IG6
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: KCTAYNOHWHMWOI-UHFFFAOYSA-N
SMILES: Cc1c(nc2n1nc(cc2)CCc3nc(cn3C)c4ccccc4)C(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Imidazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5SEM | Download | Experimental | e5semA1 e5semB1 e5semC1 e5semD1 | PDEase-like PDEase-like PDEase-like PDEase-like | LigPlot |