UCSF

ZINC00165461

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Vendors

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) 0.85 2.83 -8.93 1 3 0 42 145.165 1
Mid Mid (pH 6-8) 0.85 2.77 -7.26 1 3 0 42 145.165 1

Vendor Notes

Note Type Comments Provided By
MP 119-120° Matrix Scientific
Melting_Point 121-122? Alfa-Aesar
Melting_Point 121-122° Alfa-Aesar
melting_point 122 - 124 KeyOrganics
MP 122-124° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Matrix Scientific
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific

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