UCSF

ZINC04202565

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) -0.13 3.84 -55.57 1 5 -1 78 228.268 4
Hi High (pH 8-9.5) 3.48 13.15 -13.41 0 6 0 86 393.439 11

Vendor Notes

Note Type Comments Provided By
MP 129 - 131 Enamine Building Blocks
MP 129...131 Enamine Building Blocks
MP 130 - 132 Enamine Building Blocks
Mp [°C] 130 - 135 Acros Organics
MP 130-135 °C Indofine
Melting_Point 131-134? Alfa-Aesar
Melting_Point 131-134° Alfa-Aesar
MP 132.5-133.5o C Indofine
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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