UCSF

ZINC00111531

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) 0.93 -2.05 -5.53 2 4 0 57 154.169 2
Mid Mid (pH 6-8) 0.93 -1.11 -25.9 3 4 1 59 155.177 2

Vendor Notes

Note Type Comments Provided By
MP 210 - 212 Enamine Building Blocks
MP 43 - 45 Enamine Building Blocks
MP 43...45 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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