| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2005 | 21 | Yes |
Popular Name: ethyl 2-{[1-benzyl-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}acetate ethyl 2-{[1-benzyl-5-(hydroxymet…
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CAS Number: 478031-86-6
| 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 | -0.95 | -10.61 | 1 | 5 | 0 | 64 | 306.387 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.32 | -0.7 | -33.15 | 2 | 5 | 1 | 65 | 307.395 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 105 - 107 | KeyOrganics |
