| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2004 | 22 | No |
Popular Name: N-(4-Butoxybenzylidene)-4-acetylaniline N-(4-Butoxybenzylidene)-4-acetyl…
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CAS Number: 17224-18-9
| 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) | 4.86 | 10.01 | -9.54 | 0 | 3 | 0 | 39 | 295.382 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.86 | 10.33 | -40.45 | 1 | 3 | 1 | 40 | 296.39 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.86 | 9.63 | -43.43 | 1 | 3 | 1 | 40 | 296.39 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 120 | TCI |
| mp | 80 - 128 | MolMall (formerly Molecular Diversity Preservation International) |
