PDB ligand accession: NG2
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: SMPGEBOIKULBCT-UHFFFAOYSA-N
SMILES: CCN1CCN(CC1)Cc2ccc(cc2C(F)(F)F)NC(=O)c3ccc(c(c3)Oc4ccnc5c4cc[nH]5)C
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 |
---|---|---|---|---|---|
4O91 | Download | Experimental | e4o91A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |