| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 15 | Yes |
Popular Name: (2S)-3-[[1-(hydroxymethyl)-4-methyl-cyclohexyl]amino]propane-1,2-diol (2S)-3-[[1-(hydroxymethyl)-4-met…
| 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) | -0.06 | -3.32 | -36.62 | 5 | 4 | 1 | 77 | 218.317 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.06 | -4.49 | -6.47 | 4 | 4 | 0 | 73 | 217.309 | 5 | ↓ |
