In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 21 | Yes |
Popular Name: (1R)-2-(2,3-dimethylphenoxy)-1-(4-ethoxyphenyl)ethanamine (1R)-2-(2,3-dimethylphenoxy)-1-(…
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) | 2.34 | 7.36 | -49.05 | 3 | 3 | 1 | 46 | 286.395 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.34 | 7.07 | -4.97 | 2 | 3 | 0 | 44 | 285.387 | 6 | ↓ |