| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 17 | Yes |
Popular Name: (2S)-1-(dimethylamino)-3-[[(1R,3S)-1-(hydroxymethyl)-3-methyl-cyclohexyl]amino]propan-2-ol (2S)-1-(dimethylamino)-3-[[(1R,3…
| 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) | 0.83 | 1.21 | -97.75 | 5 | 4 | 2 | 61 | 246.395 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.83 | 1.72 | -40.32 | 4 | 4 | 1 | 64 | 245.387 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.83 | -1.38 | -34.79 | 4 | 4 | 1 | 60 | 245.387 | 6 | ↓ |
