In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2010 | 25 | Yes |
Popular Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-1-(3,4,5-trimethoxyphenyl)methanamine 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) | 3.15 | 6.65 | -65.24 | 2 | 6 | 1 | 63 | 411.272 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.15 | 5.29 | -12.71 | 1 | 6 | 0 | 58 | 410.264 | 7 | ↓ |