| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2004 | 30 | Yes |
Popular Name: beta-toxicarol beta-toxicarol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 82-11-1 , CAS# 82-11-1
None
| 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) | 3.29 | 7.17 | -13.33 | 1 | 7 | 0 | 83 | 410.422 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.29 | 8.16 | -58.51 | 0 | 7 | -1 | 86 | 409.414 | 2 | ↓ |
