PDB ligand accession: I30
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: QYPYMNJXDLGLRD-AWQFTUOYSA-N
SMILES: CC(=NNC(=O)c1cc(ccc1O)Br)c2[nH]c3ccccc3n2
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3T0T | Download | Experimental | e3t0tA2 e3t0tB2 e3t0tD2 e3t0tC2 | PK C-terminal domain-like PK C-terminal domain-like PK C-terminal domain-like PK C-terminal domain-like | LigPlot |