In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 9th, 2009 | 30 | Yes |
Popular Name: 3,7-dimethyl-1-[3-[[5-(pyrrolidine-1-carbonyl)-2-pyridyl]sulfanyl]propyl]purine-2,6-dione 3,7-dimethyl-1-[3-[[5-(pyrrolidi…
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) | 1.03 | 10.41 | -19.72 | 0 | 9 | 0 | 95 | 428.518 | 6 | ↓ |