| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 14 | Yes |
Popular Name: (2S)-2-[[(1S,3R)-1-(hydroxymethyl)-3-methyl-cyclohexyl]amino]propanenitrile (2S)-2-[[(1S,3R)-1-(hydroxymethy…
| 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) | 1.56 | 1.27 | -7.59 | 2 | 3 | 0 | 56 | 196.294 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.56 | 2.3 | -38.84 | 3 | 3 | 1 | 61 | 197.302 | 3 | ↓ |
