UCSF

ZINC54954743

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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) 0.16 1.46 -4.82 2 3 0 52 131.175 3

Vendor Notes

Note Type Comments Provided By
Melting_Point 112-114? Alfa-Aesar
Melting_Point 112-114° Alfa-Aesar
MP 162-167o C Indofine
Mp [°C] 170 Acros Organics
MP 171 - 173 Enamine Building Blocks
MP 171 °C Indofine
MP 171-173° Fluorochem
purity 9.500000000000000e+001 Enamine Building Blocks
MP 93 - 95 Enamine Building Blocks
MP 93...95 Enamine Building Blocks
purity 95 Enamine Building Blocks
Purity 95+% Matrix Scientific
Purity 98% Fluorochem
Purity 99% Fluorochem
Melting_Point ca 170? dec. Alfa-Aesar
Melting_Point ca 170° dec. Alfa-Aesar
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
MP ~170 °C (dec.) Indofine

Activity (Go SEA)

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