In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2010 | 24 | Yes |
Popular Name: 1-[(7-bromo-2,3-dihydro-1,4-benzodioxin-6-yl)methyl]-4-(1-piperidyl)piperidine 1-[(7-bromo-2,3-dihydro-1,4-benz…
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) | 3.31 | 8.82 | -34.3 | 1 | 4 | 1 | 26 | 396.349 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.31 | 10.9 | -101.81 | 2 | 4 | 2 | 27 | 397.357 | 3 | ↓ |