In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 8th, 2008 | 29 | Yes |
Popular Name: 1-[2-(4-fluorophenoxy)ethyl]-3,7-diisobutyl-purine-2,6-dione 1-[2-(4-fluorophenoxy)ethyl]-3,7…
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) | 4.15 | 13.03 | -11.91 | 0 | 7 | 0 | 71 | 402.47 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.15 | 13.52 | -48.24 | 1 | 7 | 1 | 72 | 403.478 | 8 | ↓ |