| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 13 | Yes |
Popular Name: (2S)-2-(4-chloro-3-fluoro-phenyl)-2-(methylamino)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) | 2.23 | 4.09 | -7.35 | 1 | 2 | 0 | 36 | 198.628 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.23 | 5.24 | -55.44 | 2 | 2 | 1 | 40 | 199.636 | 2 | ↓ |
