PDB ligand accession: 3UX
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: RYCBSDWTFORSET-UIFIKXQLSA-N
SMILES: CC12CCCOC1C3(c4cc(ccc4O2)c5cccnc5F)C(=O)N(C(=N3)N)C
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 |
---|---|---|---|---|---|
4RRO | Download | Experimental | e4rroA1 e4rroA2 | cradle loop barrel cradle loop barrel | LigPlot |