UCSF

ZINC19850311

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) -0.14 0.78 -46.99 3 5 1 62 227.313 3
Hi High (pH 8-9.5) -0.14 -0.59 -13.48 2 5 0 57 226.305 3
Mid Mid (pH 6-8) -0.32 0.6 -30.55 2 5 0 65 226.305 3
Mid Mid (pH 6-8) 0.42 1 -30.09 3 5 1 62 227.313 2

Vendor Notes

Note Type Comments Provided By
MP 205° Oakwood Chemical
Purity 97% Fluorochem

Activity (Go SEA)

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