UCSF

ZINC17303025

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2008 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) 2.80 3 -5 1 2 0 33 135.166 1
Ref Reference (pH 7) 1.98 3.22 -3.32 0 2 0 29 135.166 2

Vendor Notes

Note Type Comments Provided By
M.P 114.5-116.5oC Indofine
mp 126 MolMall (formerly Molecular Diversity Preservation International)
MP 75 - 77 Enamine Building Blocks
MP 75...77 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

Activity (Go SEA)

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