PDB ligand accession: 2S7
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: CXFJNJZPBYIKCK-SANMLTNESA-N
SMILES: c1ccnc(c1)C(C2CCCC2)(C3CCN(CC3)CCCOc4ccc(cc4)C#N)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: None
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4OG5 | Download | Experimental | e4og5A1 e4og5A2 | Repetitive alpha hairpins Cysteine proteinases-like | LigPlot |