In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 21 | Yes |
Popular Name: 2-[[4-oxo-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]acetonitrile 2-[[4-oxo-5-(p-tolyl)-3H-thieno[…
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) | 4.63 | 6.79 | -42.12 | 0 | 4 | -1 | 73 | 312.399 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.18 | 7.9 | -13.9 | 1 | 4 | 0 | 70 | 313.407 | 3 | ↓ |