| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 11 | Yes |
Popular Name: (2S)-1-amino-3-[(2S)-3-amino-2-hydroxy-propoxy]propan-2-ol (2S)-1-amino-3-[(2S)-3-amino-2-h…
| 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) | -3.38 | -7.4 | -96.36 | 8 | 5 | 2 | 105 | 166.221 | 6 | ↓ |
| Hi High (pH 8-9.5) | -3.38 | -8.15 | -7.98 | 6 | 5 | 0 | 102 | 164.205 | 6 | ↓ |
| Hi High (pH 8-9.5) | -3.38 | -7.77 | -46.54 | 7 | 5 | 1 | 103 | 165.213 | 6 | ↓ |
