PDB ligand accession: A2E
DrugBank: DB04615
PubChem: 5287576;5326967;
ChEMBL: n/a
InChI Key: ROTFGKJJMRTWBD-MHZLTWQESA-N
SMILES: c1ccc2c(c1)c(c3c(n2)CCCC3)NCCCCCCCCCCNC4CCCC5=C4C=CC(=O)N5
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 |
---|---|---|---|---|---|
1ZGC | Download | Experimental | e1zgcA1 e1zgcB1 | alpha/beta-Hydrolases alpha/beta-Hydrolases | LigPlot |