PDB ligand accession: 0EV
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: WJSLFMAXPWEECW-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CCNc2[nH]c3c(n2)cc4c(c3CCNCC5CCCCC5)N=CNC4=O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazanaphthalenes
- Subclass: Benzodiazines
- Class: Diazanaphthalenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4GH3 | Download | Experimental | e4gh3A1 | TIM beta/alpha-barrel | LigPlot |