UCSF

ZINC19816748

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) 0.62 1.02 -48 4 4 1 60 226.344 3
Mid Mid (pH 6-8) 0.62 2.93 -38.39 4 4 1 60 226.344 3
Mid Mid (pH 6-8) 0.62 3.25 -107.55 5 4 2 61 227.352 3

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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