| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 26th, 2010 | 15 | Yes |
Popular Name: (2S)-3-[[(1S)-1-(2-chlorophenyl)ethyl]amino]-2-methyl-propanenitrile (2S)-3-[[(1S)-1-(2-chlorophenyl)…
| 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) | 3.22 | 6.61 | -6.98 | 1 | 2 | 0 | 36 | 222.719 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.22 | 7.46 | -51.79 | 2 | 2 | 1 | 40 | 223.727 | 4 | ↓ |
