In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2006 | 25 | Yes |
Popular Name: 8-(3-fluorophenyl)-7-(2-methoxyethyl)-3-propyl-purine-2,6-dione 8-(3-fluorophenyl)-7-(2-methoxye…
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) | 2.17 | 6.88 | -9.04 | 1 | 7 | 0 | 82 | 346.362 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.17 | 7.32 | -36.43 | 2 | 7 | 1 | 83 | 347.37 | 6 | ↓ |