In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 18th, 2011 | 21 | Yes |
Popular Name: benzoic acid, 3-bromo-4-(2-methylpropoxy)-, (tetrahydro-2-furanyl)methyl ester benzoic acid, 3-bromo-4-(2-methy…
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) | 4.40 | 8.85 | -7 | 0 | 4 | 0 | 45 | 357.244 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.