UCSF

ZINC03860442

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 10 No

Download: MOL2 SDF SMILES Flexibase

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) 1.57 4.12 -8.27 0 2 0 26 140.182 2

Vendor Notes

Note Type Comments Provided By
BP [°C] 76 - 78 (p=1 torr) Acros Organics
Boiling_Point 76-78?/1mm Alfa-Aesar
Boiling_Point 76-78°/1mm Alfa-Aesar
Purity 95% Fluorochem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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