In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2004 | 31 | Yes |
Popular Name: 2-[[2-keto-2-(2-naphthyl)ethyl]thio]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-olate 2-[[2-keto-2-(2-naphthyl)ethyl]t…
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) | 7.18 | 11.56 | -48.72 | 0 | 4 | -1 | 66 | 441.557 | 5 | ↓ |
Mid Mid (pH 6-8) | 6.72 | 12.8 | -17.53 | 1 | 4 | 0 | 63 | 442.565 | 5 | ↓ |