In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 26th, 2008 | 20 | Yes |
Popular Name: 7-(2-dimethylaminoethyl)-1-methyl-3-propyl-purine-2,6-dione 7-(2-dimethylaminoethyl)-1-methy…
None
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) | 0.97 | 8.83 | -47.91 | 1 | 7 | 1 | 66 | 280.352 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.97 | 9.32 | -112.29 | 2 | 7 | 2 | 68 | 281.36 | 5 | ↓ |