| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 16 | Yes |
Popular Name: (2S)-2-[4-[(2S)-3-amino-2-methyl-propyl]piperazin-1-yl]propanamide (2S)-2-[4-[(2S)-3-amino-2-methyl…
| 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) | -0.59 | -0.76 | -106.4 | 6 | 5 | 2 | 78 | 230.356 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.59 | -3.12 | -7.59 | 4 | 5 | 0 | 76 | 228.34 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.59 | -0.58 | -90.81 | 6 | 5 | 2 | 78 | 230.356 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.59 | -2.75 | -48.72 | 5 | 5 | 1 | 77 | 229.348 | 5 | ↓ |
