| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2008 | 21 | Yes |
Popular Name: 4-[[[(1S)-1-(2,4-dichlorophenyl)ethyl]amino]methyl]-3-fluoro-benzonitrile 4-[[[(1S)-1-(2,4-dichlorophenyl)…
| 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) | 4.59 | 9.14 | -5.8 | 1 | 2 | 0 | 36 | 323.198 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.59 | 10.43 | -54.31 | 2 | 2 | 1 | 40 | 324.206 | 4 | ↓ |
