PDB ligand accession: 3EK
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: PBYUEXSDWHTFAM-IYARVYRRSA-N
SMILES: Cc1cc(cc(n1)C(=O)NCc2ccc(cc2)F)c3ncn(n3)CC4CCC(CC4)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyridinecarboxylic acids and derivatives
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3KEK | Download | Experimental | e3kekA1 e3kekB1 | Zincin-like Zincin-like | LigPlot |