UCSF

ZINC01529915

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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) 2.36 5.24 -50.49 1 5 -1 78 230.284 6

Vendor Notes

Note Type Comments Provided By
Mp [°C] 82 - 85 Acros Organics
Melting_Point 84-87? Alfa-Aesar
Melting_Point 84-87° Alfa-Aesar
MP 85 - 87 Enamine Building Blocks
MP 85-87 °C(lit.) Indofine
MP 85...87 Enamine Building Blocks
MP 87 TCI
MP 87 - 89 Enamine Building Blocks
MP 87...89 Enamine Building Blocks
Mp [°C] 87.5 - 88.7 Acros Organics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 98% Fluorochem
PUBCHEM_PATENT_ID EP0167919A2; EP0167919B1; EP0284256A1; EP0295316A2; EP0295316B1 IBM Patent Data
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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