In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 23 | Yes |
Popular Name: (1R)-1-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethoxyphenyl)methyl]ethanamine (1R)-1-(1,3-benzodioxol-5-yl)-N-…
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) | 3.39 | 6.21 | -45.8 | 2 | 5 | 1 | 54 | 316.377 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.39 | 5.05 | -8.87 | 1 | 5 | 0 | 49 | 315.369 | 6 | ↓ |