PDB ligand accession: 2EX
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: DWEUDIDNAOSEBW-UVFQYZLESA-N
SMILES: CN1C(=O)C2(c3cc(ccc3OC4C2COCC4)c5cccnc5F)N=C1N
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 |
---|---|---|---|---|---|
4N00 | Download | Experimental | e4n00A1 e4n00A2 | cradle loop barrel cradle loop barrel | LigPlot |