| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2009 | 16 | Yes |
Popular Name: (2S)-3-[2-(4-methoxyphenyl)ethylamino]-2-methyl-propanenitrile (2S)-3-[2-(4-methoxyphenyl)ethyl…
| 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) | 2.14 | 6.43 | -58.34 | 2 | 3 | 1 | 50 | 219.308 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.14 | 5.23 | -8.1 | 1 | 3 | 0 | 45 | 218.3 | 6 | ↓ |
