UCSF

ZINC00130672

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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) -0.03 7.7 -57.16 0 5 -1 70 248.258 4

Vendor Notes

Note Type Comments Provided By
MP 101-102° Matrix Scientific
Mp [°C] 74.6 Acros Organics
MP 75-76.5o C Indofine
MP 76 TCI
MP 76 - 78 Enamine Building Blocks
MP 76-78 °C(lit.) Indofine
Melting_Point 76-78? Alfa-Aesar
Melting_Point 76-78° Alfa-Aesar
MP 76...78 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
PUBCHEM_PATENT_ID WO1997032580A1 IBM Patent Data

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