| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2004 | 17 | Yes |
Popular Name: 7-(3-methylphenyl)-7-oxoheptanoic acid 7-(3-methylphenyl)-7-oxoheptanoi…
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CAS Number: 898765-39-4
| 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) | 3.19 | 9.47 | -51.72 | 0 | 3 | -1 | 57 | 233.287 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.19 | 7.49 | -13.34 | 1 | 3 | 0 | 54 | 234.295 | 7 | ↓ |
