In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 20 | Yes |
Popular Name: 3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-7H-purine-2,6-dione 3-ethyl-1-[2-(2-methoxyethoxy)et…
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) | 0.15 | 5.09 | -14.42 | 1 | 8 | 0 | 91 | 282.3 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.34 | 3.76 | -40.54 | 0 | 8 | -1 | 94 | 281.292 | 7 | ↓ |