UCSF

ZINC05594926

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) 1.71 3.5 -10.24 3 3 0 55 177.182 1
Ref Reference (pH 7) 1.71 3.44 -7.46 3 3 0 55 177.182 1
Lo Low (pH 4.5-6) 1.71 3.57 -26.9 4 3 1 56 178.19 1

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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