PDB ligand accession: Q3B
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: ABVBWRLOEHXZBY-FQEVSTJZSA-N
SMILES: COc1ccc(cc1)NC(=O)Nc2cccc(c2)c3c(n(cn3)CC4CCCO4)c5nc6c(ncnc6s5)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Imidazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5ALI | Download | Experimental | e5aliA1 | alpha/beta-Hydrolases | LigPlot |