| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 25th, 2006 | 24 | No |
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CAS Number: 1864003-43-9
| 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) | 2.89 | 7.37 | -13.38 | 0 | 6 | 0 | 54 | 325.368 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.89 | 8.21 | -32.03 | 1 | 6 | 1 | 56 | 326.376 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 186 - 188 | KeyOrganics |
