PDB ligand accession: 2HH
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: LSEUGEFZKAZGSI-UHFFFAOYSA-N
SMILES: Cn1c(ccn1)C(=O)Nc2cccnc2
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Carboxylic acid derivatives
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4N9B | Download | Experimental | e4n9bA2 e4n9bB2 e4n9bA1 e4n9bA2 e4n9bB1 | TIM beta/alpha-barrel alpha/beta-Hammerhead/Barrel-sandwich hybrid alpha/beta-Hammerhead/Barrel-sandwich hybrid TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |