| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 25 | Yes |
Popular Name: N-{5-acetyl-6-[(E)-2-(dimethylamino)ethenyl]-2-oxo-2H-pyran-3-yl}-4-methylbenzenecarboxamide N-{5-acetyl-6-[(E)-2-(dimethylam…
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CAS Number: 1164563-84-1
| 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) | 2.27 | 9.4 | -21.26 | 1 | 6 | 0 | 80 | 340.379 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.27 | 9.79 | -18.89 | 1 | 6 | 0 | 80 | 340.379 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 209 - 211 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.
