PDB ligand accession: 5JJ
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: XBWBLXQDIZDDLL-UHFFFAOYSA-N
SMILES: CCC#CCN(c1ccc2c(c1)c(ccn2)N)c3c(cccc3Cl)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic nitrogen compounds
- Class: Organonitrogen compounds
- Subclass: Amines
- Class: Organonitrogen compounds
- Superclass: Organic nitrogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5MW3 | Download | Experimental | e5mw3A1 e5mw3B1 | Rossmann-like Rossmann-like | LigPlot |
5MVS | Download | Experimental | e5mvsA1 e5mvsB1 | Rossmann-like Rossmann-like | LigPlot |