PDB ligand accession: CDB
DrugBank: DB07549
PubChem:
ChEMBL: n/a
InChI Key: WOYBPRBUPLYTPY-UHFFFAOYSA-P
SMILES: Cc1ccnc(c1F)CNC(=O)CN2C(=C[NH+]=C(C2=O)NCC(c3cccc[nH+]3)(F)F)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Methylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1MU8 | Download | Experimental | e1mu8.1 | cradle loop barrel | LigPlot |