| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 16 | Yes |
Popular Name: (2S)-2-(4-chloro-3-fluoro-phenyl)-2-(isobutylamino)acetonitrile (2S)-2-(4-chloro-3-fluoro-phenyl…
| 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) | 3.36 | 6.47 | -6.94 | 1 | 2 | 0 | 36 | 240.709 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.36 | 7.53 | -54.36 | 2 | 2 | 1 | 40 | 241.717 | 4 | ↓ |
