PDB ligand accession: BDY
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: PVBCEWZVPUKFNT-HXUWFJFHSA-N
SMILES: c1cc(c(c(c1)Cl)CNc2c(ncc(n2)c3ccc(cc3)C(=O)N4CCCC4CN5CCCC5)N)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3LCD | Download | Experimental | e3lcdA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |