| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 16 | Yes |
Popular Name: (2S)-2-(4-chloro-3-fluoro-phenyl)-2-[[(1R)-1-methylpropyl]amino]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) | 3.44 | 6.64 | -6.92 | 1 | 2 | 0 | 36 | 240.709 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.44 | 7.39 | -49.52 | 2 | 2 | 1 | 40 | 241.717 | 4 | ↓ |
