UCSF

ZINC19388998

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) 1.23 2.44 -49.69 4 4 1 60 248.35 3
Mid Mid (pH 6-8) 1.23 4.35 -41.99 4 4 1 60 248.35 3
Mid Mid (pH 6-8) 1.23 4.66 -111.97 5 4 2 61 249.358 3

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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