PDB ligand accession: R40
DrugBank: n/a
PubChem: 71055;1549129;
ChEMBL:
InChI Key: SJSSFUMSAFMFNM-NSHDSACASA-N
SMILES: c1ccc(cc1)COC(=O)NC(CCCNC(=N)N)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzyloxycarbonyls
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5IYY | Download | Experimental | e5iyyA1 e5iyyB1 | jelly-roll jelly-roll | LigPlot |