| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 17 | Yes |
Popular Name: 3-[[[(2R)-1,4-dioxan-2-yl]methylamino]methyl]benzonitrile 3-[[[(2R)-1,4-dioxan-2-yl]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) | 0.86 | 4.9 | -51.24 | 2 | 4 | 1 | 59 | 233.291 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.86 | 3.49 | -8.35 | 1 | 4 | 0 | 54 | 232.283 | 4 | ↓ |
