| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2010 | 15 | Yes |
Popular Name: 3-[[(1S)-1-(3-chlorophenyl)ethyl]-methyl-amino]propanenitrile 3-[[(1S)-1-(3-chlorophenyl)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) | 2.41 | 6.63 | -6.65 | 0 | 2 | 0 | 27 | 222.719 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.41 | 8.71 | -52.1 | 1 | 2 | 1 | 28 | 223.727 | 4 | ↓ |
