PDB ligand accession: MWT
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: OPGOAZPEMDHEOI-UHFFFAOYSA-O
SMILES: C[n+]1c(cn(n1)c2ccc(c(c2)OCCN3CCNC3=O)c4nc(cs4)CCc5ccccc5)CCCCN
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Triazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6T95 | Download | Experimental | e6t95A3 | Rossmann-like | LigPlot |