PDB ligand accession: H1B
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: WRUWGLUCNBMGPS-UHFFFAOYSA-N
SMILES: CCN1C=C(c2c(cc(s2)C(=NC3CCS(=O)(=O)CC3)N)C1=O)c4cccc(c4)C(F)(F)F
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 |
---|---|---|---|---|---|
6V1B | Download | Experimental | e6v1bA1 e6v1bB1 | Bromodomain-like Bromodomain-like | LigPlot |