In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 8th, 2009 | 22 | Yes |
Popular Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-2-(4-methoxyphenyl)ethanamine N-[(7-bromo-1,3-benzodioxol-5-yl…
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) | 3.98 | 7.61 | -57.25 | 2 | 4 | 1 | 44 | 365.247 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.98 | 6.2 | -7.87 | 1 | 4 | 0 | 40 | 364.239 | 6 | ↓ |