In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 21 | Yes |
Popular Name: (1R)-1-(1,3-benzodioxol-5-yl)-2-(2-morpholinoethylamino)ethanol (1R)-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) | 0.33 | 0.21 | -56.8 | 3 | 6 | 1 | 68 | 295.359 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.33 | -1.28 | -8.32 | 2 | 6 | 0 | 63 | 294.351 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.33 | 1.04 | -43.91 | 3 | 6 | 1 | 64 | 295.359 | 6 | ↓ |