| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 17 | Yes |
Popular Name: (2S)-2-(4-tert-butylpiperazin-1-yl)-3-methyl-butanoic (2S)-2-(4-tert-butylpiperazin-1-…
| 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) | 0.32 | 6.63 | -52.3 | 1 | 4 | 0 | 48 | 242.363 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.32 | 4.57 | -46.87 | 0 | 4 | -1 | 47 | 241.355 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.32 | 6.24 | -29.84 | 1 | 4 | 0 | 48 | 242.363 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.32 | 8.44 | -81.54 | 2 | 4 | 1 | 49 | 243.371 | 4 | ↓ |
