PDB ligand accession: MDL
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: WFJABZVISMTOSO-ZRBLBEILSA-N
SMILES: CNC(Cc1ccccc1)C(=O)N2CCCC2C(=O)NC(Cc3c[nH]c4c3cccc4)C(=O)C(C(F)(F)F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1AD8 | Download | Experimental | e1ad8.1 | cradle loop barrel | LigPlot |