| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2008 | 25 | Yes |
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CAS Number: 172426-87-8
| 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) | -1.05 | 5.05 | -114.48 | 4 | 7 | 0 | 111 | 349.362 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.05 | 4.74 | -66.91 | 3 | 7 | -1 | 109 | 348.354 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
