PDB ligand accession: IT5
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: GPPHSVWKEUXGQQ-UHFFFAOYSA-N
SMILES: c1ccc(cc1)C2(CCN(CC2)C(=S)S)C#N
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 |
---|---|---|---|---|---|
3P5L | Download | Experimental | e3p5lA1 | Carbonic anhydrase | LigPlot |