In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 26 | Yes |
Popular Name: 2-[(2S)-4-[(2,4-difluorophenyl)methyl]-1-[(4-fluorophenyl)methyl]piperazin-2-yl]ethanol 2-[(2S)-4-[(2,4-difluorophenyl)m…
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) | 3.08 | 7.47 | -44.97 | 2 | 3 | 1 | 28 | 365.419 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 7.31 | -43.5 | 2 | 3 | 1 | 28 | 365.419 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 5.18 | -6.31 | 1 | 3 | 0 | 27 | 364.411 | 6 | ↓ |