In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 24 | Yes |
Popular Name: (2S)-1-[2-(4-bromo-2,6-difluoro-phenoxy)ethoxy]-3-[(3S)-3-methyl-1-piperidyl]propan-2-ol (2S)-1-[2-(4-bromo-2,6-difluoro-…
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) | 3.41 | 7.55 | -37 | 2 | 4 | 1 | 43 | 409.291 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.72 | 8.39 | -47.28 | 2 | 4 | 1 | 46 | 332.493 | 7 | ↓ |