PDB ligand accession: 0FS
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: NGJLOFCOEOHFKQ-YVMONPNESA-N
SMILES: c1cc(cc(c1)C(F)(F)F)C=C2C(=O)NC(=O)S2
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Trifluoromethylbenzenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3VC4 | Download | Experimental | e3vc4A2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |