In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 21 | Yes |
Popular Name: (1R)-1-(1,3-benzodioxol-5-yl)-2-[(1-methyl-4-piperidyl)methylamino]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) | 1.25 | 4.82 | -107.58 | 4 | 5 | 2 | 60 | 294.395 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.25 | 3.57 | -38.13 | 3 | 5 | 1 | 55 | 293.387 | 5 | ↓ |