| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 16 | Yes |
Popular Name: (2S)-2-(4-isopropylpiperazin-1-yl)-3-methyl-butanoic (2S)-2-(4-isopropylpiperazin-1-y…
| 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) | -0.19 | 5.92 | -28.81 | 1 | 4 | 0 | 48 | 228.336 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.19 | 4.27 | -46.84 | 0 | 4 | -1 | 47 | 227.328 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.19 | 5.98 | -44.87 | 1 | 4 | 0 | 48 | 228.336 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.19 | 8.13 | -81.53 | 2 | 4 | 1 | 49 | 229.344 | 4 | ↓ |
