| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 14 | Yes |
Popular Name: 3-[[(1S)-1-(2-hydroxyphenyl)ethyl]amino]propanenitrile 3-[[(1S)-1-(2-hydroxyphenyl)ethy…
| 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) | 1.45 | 2.49 | -10.45 | 2 | 3 | 0 | 56 | 190.246 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 3.28 | -46.51 | 1 | 3 | -1 | 59 | 189.238 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 3.76 | -55.39 | 3 | 3 | 1 | 61 | 191.254 | 4 | ↓ |
