| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 19 | Yes |
Popular Name: 1-(4-chlorophenyl)-2-{[5-(hydroxymethyl)-1-methyl-1H-imidazol-2-yl]sulfanyl}-1-ethanone 1-(4-chlorophenyl)-2-{[5-(hydrox…
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CAS Numbers: 338422-49-4 , [338422-49-4]
| 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) | 2.32 | 5.57 | -10.94 | 1 | 4 | 0 | 55 | 296.779 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.32 | 6.06 | -36.31 | 2 | 4 | 1 | 56 | 297.787 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 115 - 118 | KeyOrganics |
| MP | 115-118° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
