UCSF

ZINC13483634

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) -0.16 1.42 -44.34 3 3 1 44 192.286 2
Mid Mid (pH 6-8) -0.16 3.37 -32.49 3 3 1 43 192.286 2
Mid Mid (pH 6-8) -0.16 2.15 -85.02 4 3 2 45 193.294 2
Lo Low (pH 4.5-6) -0.16 3.97 -186.82 5 3 3 46 194.302 2

Vendor Notes

Note Type Comments Provided By
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% )