| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2008 | 29 | Yes |
Popular Name: 2-[4-[2-[(4-fluorophenyl)amino]-2-oxo-ethyl]piperazin-1-yl]-N-(3-methoxyphenyl)acetamide 2-[4-[2-[(4-fluorophenyl)amino]-…
| 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 | 1.94 | -16.02 | 2 | 7 | 0 | 77 | 400.454 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.77 | 3.69 | -17.18 | 2 | 7 | 0 | 74 | 400.454 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.77 | 5.89 | -49.47 | 3 | 7 | 1 | 75 | 401.462 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.77 | 5.89 | -47.09 | 3 | 7 | 1 | 75 | 401.462 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.59 | 4.15 | -49.52 | 3 | 7 | 1 | 79 | 401.462 | 7 | ↓ |
