In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 28 | Yes |
Popular Name: (1S)-1-[1-[2-(2,3-dimethoxyphenyl)ethyl]-4-piperidyl]-1-(4-fluorophenyl)ethanol (1S)-1-[1-[2-(2,3-dimethoxypheny…
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) | 4.30 | 10 | -44.98 | 2 | 4 | 1 | 43 | 388.503 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.30 | 7.77 | -7.31 | 1 | 4 | 0 | 42 | 387.495 | 7 | ↓ |