UCSF

ZINC26459890

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) 1.29 3.45 -38.92 2 3 1 43 199.031 0
Hi High (pH 8-9.5) 1.29 2.52 -30.99 0 3 -1 40 197.015 0
Mid Mid (pH 6-8) 1.29 2.8 -6.73 1 3 0 42 198.023 0

Vendor Notes

Note Type Comments Provided By
MP 292-294° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.