UCSF

ZINC06243422

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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) 1.93 6.56 -50.05 0 2 -1 40 175.207 1

Vendor Notes

Note Type Comments Provided By
Melting_Point 56-58? Alfa-Aesar
Melting_Point 56-58° Alfa-Aesar
MP 82 - 84 Enamine Building Blocks
MP 84 - 86 Enamine Building Blocks
MP 84...86 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
PUBCHEM_PATENT_ID EP0372484B1; US5028604; US5684020; US5753662 IBM Patent Data
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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