| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2006 | 21 | Yes |
Popular Name: 2-[2-(4-fluorophenyl)-2-adamantyl]acetic acid 2-[2-(4-fluorophenyl)-2-adamanty…
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CAS Number: 400081-87-0
| 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) | 4.44 | 10.21 | -43.47 | 0 | 2 | -1 | 40 | 287.354 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.44 | 8.22 | -6.03 | 1 | 2 | 0 | 37 | 288.362 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 162 - 165 | KeyOrganics |
