PDB ligand accession: WBG
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: HSVRUECLQUGTDS-UHFFFAOYSA-N
SMILES: COc1ccc(cc1)C2=C(Nc3c(c(nn3C2=O)c4ccccc4)C5=CCCCC5)Nc6ccccn6
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Pyrazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7KCC | Download | Experimental | e7kccA1 e7kccA2 e7kccA3 | Alpha-lytic protease prodomain-like Alpha-lytic protease prodomain-like Alpha-lytic protease prodomain-like | LigPlot |