In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 21 | Yes |
Popular Name: 6-[[(1-ethyl-4-piperidyl)methylamino]methyl]-1,3-benzodioxol-5-ol 6-[[(1-ethyl-4-piperidyl)methyla…
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) | 2.48 | 5.12 | -107.97 | 4 | 5 | 2 | 60 | 294.395 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.48 | 5.78 | -77.04 | 3 | 5 | 1 | 63 | 293.387 | 5 | ↓ |