| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2009 | 32 | No |
Popular Name: 5alpha,8alpha-epidioxy-stigmasta-6,9(11),22E-trien-3beta-ol 5alpha,8alpha-epidioxy-stigmasta…
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) | 7.03 | 11.22 | -5.63 | 1 | 3 | 0 | 39 | 440.668 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Q9N1N9-2-E | Butyrylcholinesterase (cluster #2 Of 2), Eukaryotic | Eukaryotes | 6900 | 0.23 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Q9N1N9_HORSE | Q9N1N9 | Butyrylcholinesterase, Horse | 5000 | 0.23 | Binding ≤ 10μM |
