PDB ligand accession: 731
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: XLKHZSCZDIPGBV-UHFFFAOYSA-N
SMILES: Cc1c(sc(n1)C)c2cc(n[nH]2)C(=O)N3CCN(CC3)c4ccccc4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazinanes
- Subclass: Piperazines
- Class: Diazinanes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5LR6 | Download | Experimental | e5lr6A1 e5lr6C1 e5lr6B1 e5lr6D1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |