PDB ligand accession: 7LI
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ULMRMVZQMKZWKJ-MLJKTZRHSA-N
SMILES: CC(C)Oc1cccc(c1N2CCCC(C2)N)C=C3C(=O)NC(=O)S3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Piperidines
- Subclass: Phenylpiperidines
- Class: Piperidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4DTK | Download | Experimental | e4dtkA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |