PDB ligand accession: TNH
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QMTDQDYAGOQABA-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)c(c3c(n2)CCCC3)NCCCCCCNC(=O)c4cccnc4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Benzoquinolines
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4X3C | Download | Experimental | e4x3cA1 | alpha/beta-Hydrolases | LigPlot |