UCSF

ZINC02034671

Physical Representations

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) 3.07 -0.47 -2.98 1 1 0 20 164.248 4

Vendor Notes

Note Type Comments Provided By
bp 100 - 103 (p=3 torr) MolMall (formerly Molecular Diversity Preservation International)
BP 137 / 21 TCI
Boiling_Point 137?/2mm Alfa-Aesar
Boiling_Point 137°/2mm Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Therapy choleretic SMDC Pharmakon

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )