| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 1st, 2008 | 28 | Yes |
Popular Name: benzoic acid, 3-bromo-4-methyl-, 1,6-hexanediyl ester benzoic acid, 3-bromo-4-methyl-,…
| 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) | 7.83 | 15.55 | -10.85 | 0 | 4 | 0 | 53 | 512.238 | 11 | ↓ |
