UCSF

ZINC13126702

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) 1.71 6.32 -26.27 2 3 1 35 160.2 0
Ref Reference (pH 7) 1.54 6.3 -25.48 2 3 1 31 160.2 0
Mid Mid (pH 6-8) 1.54 5.83 -11.07 1 3 0 30 159.192 0

Vendor Notes

Note Type Comments Provided By
MP 194 - 206 Enamine Building Blocks
MP 194...206 Enamine Building Blocks
MP 198-200° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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