PDB ligand accession: VTI
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: PTYGSLKLIDGJBA-UHFFFAOYSA-N
SMILES: CC(=O)Nc1c(cc(cc1Cl)CNC(=N)NC(=O)Cn2ccc3c2cccc3)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Anilides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4IVT | Download | Experimental | e4ivtA2 e4ivtA3 | cradle loop barrel cradle loop barrel | LigPlot |