In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 20 | Yes |
Popular Name: N-[(8-bromo-2,3-dihydro-1,4-benzodioxin-6-yl)methyl]-2-pyrrolidin-1-yl-ethanamine N-[(8-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) | 2.37 | 7.54 | -124.11 | 3 | 4 | 2 | 40 | 343.265 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.37 | 6.18 | -37.57 | 2 | 4 | 1 | 35 | 342.257 | 5 | ↓ |