UCSF

ZINC12481200

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) 0.55 4.4 -93.24 3 2 2 21 144.262 2
Mid Mid (pH 6-8) 0.55 2.19 -37.06 2 2 1 20 143.254 2

Vendor Notes

Note Type Comments Provided By
MP 261 - 263 Enamine Building Blocks
MP 261...263 Enamine Building Blocks
BP 79-80°/12 Torr Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific
PUBCHEM_PATENT_ID WO2000001726A1 IBM Patent Data

Activity (Go SEA)

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