| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 18 | Yes |
Popular Name: 2-[4-[(2S)-2-amino-3-methyl-butanoyl]piperazin-1-yl]-N-methyl-acetamide 2-[4-[(2S)-2-amino-3-methyl-buta…
| 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) | -0.85 | -0.95 | -48.66 | 4 | 6 | 1 | 80 | 257.358 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.85 | 0.98 | -45.59 | 4 | 6 | 1 | 80 | 257.358 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.85 | -1.24 | -11.31 | 3 | 6 | 0 | 79 | 256.35 | 4 | ↓ |
