| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2009 | 20 | Yes |
Popular Name: (1S)-1-(1,3-benzodioxol-5-yl)-2-(3-pyridylmethylamino)ethanol (1S)-1-(1,3-benzodioxol-5-yl)-2-…
| 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) | 0.96 | 1.18 | -9.6 | 2 | 5 | 0 | 64 | 272.304 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.96 | 2.69 | -51.92 | 3 | 5 | 1 | 68 | 273.312 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.96 | 1.62 | -40.53 | 3 | 5 | 1 | 65 | 273.312 | 5 | ↓ |
