UCSF

ZINC31992562

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) 1.94 4.85 -28.69 2 2 1 16 197.346 2
Mid Mid (pH 6-8) 1.94 4.11 -39.94 2 2 1 20 197.346 2
Lo Low (pH 4.5-6) 1.94 6.23 -99.68 3 2 2 21 198.354 2

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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