| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2005 | 23 | Yes |
Popular Name: {1-benzyl-2-[(4-chlorobenzyl)sulfanyl]-1H-imidazol-5-yl}methanol {1-benzyl-2-[(4-chlorobenzyl)sul…
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CAS Number: 478031-84-4
| 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) | 4.36 | 9.5 | -9.34 | 1 | 3 | 0 | 38 | 344.867 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.36 | 9.95 | -32.33 | 2 | 3 | 1 | 39 | 345.875 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 141 - 143 | KeyOrganics |
