| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 21 | Yes |
Popular Name: 6-[[[1-(hydroxymethyl)-4-methyl-cyclohexyl]amino]methyl]-1,3-benzodioxol-5-ol 6-[[[1-(hydroxymethyl)-4-methyl-…
| 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) | 2.42 | 1.71 | -39.2 | 4 | 5 | 1 | 76 | 294.371 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.42 | 2.34 | -30.65 | 3 | 5 | 0 | 78 | 293.363 | 4 | ↓ |
