PDB ligand accession: I25
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: VVVFEPKRHINSIE-OAQYLSRUSA-N
SMILES: [H]N=C(c1ccc(cc1)NC(c2cc(cc(c2)OCC(C)(C)CN(C)C)CC)C(=O)O)N
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 |
---|---|---|---|---|---|
2V3H | Download | Experimental | e2v3h.1 | cradle loop barrel | LigPlot |