UCSF

ZINC04202319

Annotations

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) -2.28 -2.47 -37.68 2 4 0 65 131.131 1
Hi High (pH 8-9.5) 2.95 8.86 -82.08 6 7 2 102 466.536 4

Vendor Notes

Note Type Comments Provided By
MP 239 - 241 Enamine Building Blocks
MP 239...241 Enamine Building Blocks
Melting_Point 245-250? Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 97% Fluorochem

Activity (Go SEA)

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