PDB ligand accession: 71G
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: NJXPYZHXZZCTNI-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)N)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzonitriles
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5SXE | Download | Experimental | e5sxeB2 e5sxeA2 e5sxeA4 | SH2 Protein kinase/SAICAR synthase/ATP-grasp Repetitive alpha hairpins | LigPlot |