| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 25 | Yes |
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CAS Number: 478246-14-9
| 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) | 1.49 | 7.86 | -9.43 | 0 | 7 | 0 | 88 | 342.33 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.49 | 7.35 | -9.84 | 0 | 7 | 0 | 88 | 342.33 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 164 - 166 | KeyOrganics |
