| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2005 | 16 | No |
Popular Name: 4-(4-methylbenzyl)-1lambda~6~,4-thiazinane-1,1-dione 4-(4-methylbenzyl)-1lambda~6~,4-…
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CAS Number: 477858-35-8
| 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) | 1.45 | 4.98 | -53.95 | 1 | 3 | 1 | 39 | 240.348 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 2.86 | -10.55 | 0 | 3 | 0 | 37 | 239.34 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 93 - 95 | KeyOrganics |
