| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2008 | 29 | Yes |
Popular Name: 2-[4-[2-[(3-fluorophenyl)amino]-2-oxo-ethyl]piperazin-1-yl]-N-(4-methoxyphenyl)acetamide 2-[4-[2-[(3-fluorophenyl)amino]-…
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) | 2.59 | 2.11 | -11.8 | 2 | 7 | 0 | 77 | 400.454 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.77 | 5.92 | -50.75 | 3 | 7 | 1 | 75 | 401.462 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.77 | 3.69 | -17.23 | 2 | 7 | 0 | 74 | 400.454 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.77 | 5.9 | -46.98 | 3 | 7 | 1 | 75 | 401.462 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.59 | 4.32 | -44.91 | 3 | 7 | 1 | 79 | 401.462 | 7 | ↓ |
