In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2004 | 31 | Yes |
Popular Name: 2-[[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]thio]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-olate 2-[[2-(3,4-dimethoxyphenyl)-2-ke…
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) | 5.64 | 8.52 | -48.56 | 0 | 6 | -1 | 84 | 451.549 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.18 | 9.76 | -19.67 | 1 | 6 | 0 | 81 | 452.557 | 7 | ↓ |