In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2006 | 27 | Yes |
Popular Name: 1-[3-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxy-propoxy]phenyl]ethanone 1-[3-[3-[2-(3,4-dimethoxyphenyl)…
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) | 2.11 | 6.09 | -61.85 | 3 | 6 | 1 | 82 | 374.457 | 11 | ↓ |
Hi High (pH 8-9.5) | 2.11 | 4.61 | -17.38 | 2 | 6 | 0 | 77 | 373.449 | 11 | ↓ |