In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 20 | No |
Popular Name: 5,6-dimethyl-2-sulfanyl-3-[2-(2-thienyl)ethyl]thieno[2,3-d]pyrimidin-4-one 5,6-dimethyl-2-sulfanyl-3-[2-(2-…
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) | 3.10 | 9.54 | -10.03 | 1 | 3 | 0 | 38 | 322.48 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.56 | 8.39 | -38.45 | 0 | 3 | -1 | 41 | 321.472 | 3 | ↓ |