In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 2nd, 2009 | 30 | No |
Popular Name: DNC012922 DNC012922
None
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 8.62 | 13.55 | -3.07 | 1 | 1 | 0 | 20 | 414.718 | 6 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Q9N1N9-2-E | Butyrylcholinesterase (cluster #2 Of 2), Eukaryotic | Eukaryotes | 3900 | 0.25 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Q9N1N9_HORSE | Q9N1N9 | Butyrylcholinesterase, Horse | 3700 | 0.25 | Binding ≤ 10μM |