In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 15 | Yes |
Popular Name: (6-ethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)acetonitrile (6-ethyl-4-oxo-3,4-dihydrothieno…
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CAS Number: 926272-00-6
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) | 1.61 | 4.76 | -19.14 | 1 | 4 | 0 | 70 | 219.269 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.07 | 3.66 | -41.89 | 0 | 4 | -1 | 73 | 218.261 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 236 - 238 | Enamine Building Blocks |
MP | 236...238 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |