In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2008 | 25 | Yes |
Popular Name: 7-(2-ethoxyethyl)-3-methyl-8-(3,4,5-trimethylpyrazol-1-yl)purine-2,6-dione 7-(2-ethoxyethyl)-3-methyl-8-(3,…
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) | 0.70 | 0.13 | -9.81 | 1 | 9 | 0 | 100 | 346.391 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.70 | 0.32 | -33.63 | 2 | 9 | 1 | 101 | 347.399 | 5 | ↓ |