UCSF

ZINC04118742

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2005 26 Yes

CAS Numbers: 978-86-9 , [978-86-9]

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) 6.28 11.67 -4.94 1 1 0 20 336.434 4

Vendor Notes

Note Type Comments Provided By
Melting_Point 276-286? Alfa-Aesar
Melting_Point 276-286° Alfa-Aesar
Purity 95% Fluorochem

Activity (Go SEA)

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