| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2012 | 30 | Yes |
Popular Name: Squalene [111-02-4] Squalene [111-02-4]
| 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) | 9.39 | 21.53 | -1.05 | 0 | 0 | 0 | 0 | 410.73 | 15 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 75 °C(lit.) | Indofine |
| PUBCHEM_PATENT_ID | EP0781552A1; EP0787716A1; EP0787716B1; US5756475; US6011069; WO1999058132A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.