In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 29 | Yes |
Popular Name: 7-(3,3-dimethyl-2-oxo-butyl)-1-ethyl-3-(4-isopropylphenyl)purine-2,6-dione 7-(3,3-dimethyl-2-oxo-butyl)-1-e…
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) | 4.10 | 14.06 | -17.7 | 0 | 7 | 0 | 79 | 396.491 | 6 | ↓ |