PDB ligand accession: X2O
DrugBank: n/a
PubChem: 49843457;72199483;
ChEMBL: n/a
InChI Key: AEXWHNCQYTYTMP-QAPCUYQASA-N
SMILES: CCC(C)C(c1ccccc1)(c2ccccc2)SCC(C(=O)O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Diphenylmethanes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2X2R | Download | Experimental | e2x2rA1 e2x2rB1 e2x2rC1 | P-loop domains-like P-loop domains-like P-loop domains-like | LigPlot |