| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 17th, 2004 | 24 | Yes |
Popular Name: 2-{[4-(tert-butyl)benzyl]sulfanyl}-3-methyl-6-(trifluoromethyl)-4(3H)-pyrimidinone 2-{[4-(tert-butyl)benzyl]sulfany…
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CAS Number: 339101-55-2
| 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) | 5.10 | 3.57 | -6.68 | 0 | 3 | 0 | 34 | 356.413 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 97 - 100 | KeyOrganics |
