| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 14 | Yes |
Popular Name: alpha-Methylbenzylbutyrate alpha-Methylbenzylbutyrate
Find On: PubMed — Wikipedia — Google
CAS Number: 3460-44-4
| 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) | 2.86 | 7.85 | -44.58 | 0 | 2 | -1 | 40 | 191.25 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.86 | 6.14 | -6.82 | 1 | 2 | 0 | 37 | 192.258 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.