| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 14th, 2014 | 28 | Yes |
Popular Name: Isooctyl(9Z,12Z)-octadeca-9,12-dienoate Isooctyl(9Z,12Z)-octadeca-9,12-d…
Find On: PubMed — Wikipedia — Google
CAS Number: 67874-38-8
| 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) | 9.13 | 19.55 | -4.56 | 0 | 2 | 0 | 26 | 392.668 | 21 | ↓ |
No pre-computed analogs available. Try a structural similarity search.