UCSF

ZINC19408446

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) -0.18 1.94 -39.56 3 4 1 59 206.269 3
Hi High (pH 8-9.5) -0.18 0.58 -8.44 2 4 0 54 205.261 3
Lo Low (pH 4.5-6) -0.18 2.33 -88.86 4 4 2 60 207.277 3

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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