| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 21 | No |
Popular Name: 5,6-Dimethoxy-2-(pyridin-4-ylmethylene)-2,3-dihydro-1H-inden-1-one 5,6-Dimethoxy-2-(pyridin-4-ylmet…
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CAS Numbers: 120014-30-4 , 4803-74-1 , [4803-74-1]
(2E)-5,6-Dimethoxy-2-(pyridin-4-ylmethylene)indan-1-one
5,6-Dimethoxy-2-(piperidin-4-yl)methylene-indan-1-one
| 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) | 2.08 | 6.98 | -13 | 0 | 4 | 0 | 48 | 281.311 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.08 | 7.41 | -52.14 | 1 | 4 | 1 | 50 | 282.319 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
