In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 21 | Yes |
Popular Name: 2-[5,6-dimethyl-4-oxo-2-(3-pyridyl)thieno[2,3-d]pyrimidin-3-yl]acetonitrile 2-[5,6-dimethyl-4-oxo-2-(3-pyrid…
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) | 2.24 | 7.02 | -12.41 | 0 | 5 | 0 | 72 | 296.355 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.24 | 7.46 | -54.9 | 1 | 5 | 1 | 73 | 297.363 | 2 | ↓ |