| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 23rd, 2008 | 27 | Yes |
Popular Name: (2S)-1-(4-benzylpiperazin-1-yl)-2-[(4-methoxyphenyl)methylamino]propan-1-one (2S)-1-(4-benzylpiperazin-1-yl)-…
| 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) | 2.52 | 7.85 | -46.27 | 2 | 5 | 1 | 49 | 368.501 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | 6.53 | -9.76 | 1 | 5 | 0 | 45 | 367.493 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 8.71 | -50.48 | 2 | 5 | 1 | 46 | 368.501 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.52 | 9.92 | -110.17 | 3 | 5 | 2 | 51 | 369.509 | 7 | ↓ |
