In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 30 | Yes |
Popular Name: (2S)-1-(4-benzyl-1-piperidyl)-3-[2-(4-bromo-2,6-difluoro-phenoxy)ethoxy]propan-2-ol (2S)-1-(4-benzyl-1-piperidyl)-3-…
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) | 4.84 | 11.18 | -40.24 | 2 | 4 | 1 | 43 | 485.389 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 9.64 | -44.58 | 2 | 5 | 1 | 51 | 335.431 | 7 | ↓ |