| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2008 | 19 | Yes |
Popular Name: 4-[[[(1R,2R,3S)-2,3-dimethylcyclohexyl]amino]methyl]-3-fluoro-benzonitrile 4-[[[(1R,2R,3S)-2,3-dimethylcycl…
| 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) | 3.73 | 9.29 | -46.86 | 2 | 2 | 1 | 40 | 261.364 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.73 | 8.2 | -4.1 | 1 | 2 | 0 | 36 | 260.356 | 3 | ↓ |
