PDB ligand accession: L1H
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: DJZWMTBYRCKZMQ-UHFFFAOYSA-N
SMILES: CC(C)(Cn1c2ccccc2nc1NC(=O)c3cc(cc(c3)F)c4cccnc4)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6S9B | Download | Experimental | e6s9bA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |