| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 14 | Yes |
Popular Name: (2S)-1-amino-3-[methyl(2-pyridylmethyl)amino]propan-2-ol (2S)-1-amino-3-[methyl(2-pyridyl…
| 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) | -1.27 | -2.16 | -45.56 | 4 | 4 | 1 | 64 | 196.274 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.27 | -2.55 | -6.66 | 3 | 4 | 0 | 62 | 195.266 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.27 | -0.15 | -35.75 | 4 | 4 | 1 | 64 | 196.274 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.27 | -1.45 | -84.53 | 5 | 4 | 2 | 65 | 197.282 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.27 | 0.77 | -49.44 | 4 | 4 | 1 | 68 | 196.274 | 5 | ↓ |
