PDB ligand accession: 3W7
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: BJMKYJZZEBEMKH-UHFFFAOYSA-N
SMILES: CC(C)n1c2c(cn1)CC3(CCN(CC3)C(=O)c4ccc5c(c4)c[nH]n5)CC2=O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Piperidines
- Subclass: N-acylpiperidines
- Class: Piperidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4WZ8 | Download | Experimental | e4wz8C1 e4wz8B2 e4wz8C2 e4wz8B1 | ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase | LigPlot |