In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 19 | Yes |
Popular Name: 1-[(7-bromo-2,3-dihydro-1,4-benzodioxin-6-yl)methyl]piperidin-4-amine 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) | 1.25 | 3.19 | -44.65 | 3 | 4 | 1 | 49 | 328.23 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.25 | 5.27 | -106.91 | 4 | 4 | 2 | 51 | 329.238 | 2 | ↓ |