UCSF

ZINC02384161

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 10 Yes

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) 0.28 0.21 -39.15 1 3 -1 60 157.067 2

Vendor Notes

Note Type Comments Provided By
MP 110 TCI
Boiling_Point 189? Alfa-Aesar
Boiling_Point 189° Alfa-Aesar
Melting_Point 39-41? Alfa-Aesar
Melting_Point 39-41° Alfa-Aesar
MP 85 Matrix Scientific
Boiling_Point 87-90?/0.5mm Alfa-Aesar
Boiling_Point 87-90°/0.5mm Alfa-Aesar
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 97% Matrix Scientific
Melting_Point ca 85? Alfa-Aesar
Melting_Point ca 85° Alfa-Aesar
Warnings Corrosive/Irritant Matrix Scientific
Warnings IRRITANT Matrix Scientific
Warnings IRRITANT, CORROSIVE Matrix Scientific

Activity (Go SEA)

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