In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2010 | 21 | Yes |
Popular Name: 1-[(4-bromo-2-fluoro-phenyl)methyl]-4-(1-piperidyl)piperidine 1-[(4-bromo-2-fluoro-phenyl)meth…
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) | 3.97 | 9.47 | -38.46 | 1 | 2 | 1 | 8 | 356.303 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.97 | 9.63 | -33.34 | 1 | 2 | 1 | 8 | 356.303 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.97 | 11.86 | -104.56 | 2 | 2 | 2 | 9 | 357.311 | 3 | ↓ |