| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2006 | 24 | Yes |
Popular Name: 2-(2-(4-bromophenyl)-2-oxoethyl)-5-phenylcyclohexane-1,3-dione 2-(2-(4-bromophenyl)-2-oxoethyl)…
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CAS Number: 1022235-54-6
| 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) | 3.72 | 12.35 | -19.07 | 0 | 3 | 0 | 51 | 385.257 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.30 | 12.4 | -43.61 | 0 | 3 | -1 | 57 | 384.249 | 4 | ↓ |
