| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 17 | Yes |
Popular Name: (1S,2S)-2-[methyl(3-pyridylmethyl)amino]cyclohexanecarbonitrile (1S,2S)-2-[methyl(3-pyridylmethy…
| 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) | 2.06 | 7.59 | -43.47 | 1 | 3 | 1 | 41 | 230.335 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.06 | 5.64 | -7.99 | 0 | 3 | 0 | 40 | 229.327 | 3 | ↓ |
