UCSF

ZINC35609636

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) -1.09 -2.05 -42.98 4 5 1 71 230.332 4
Hi High (pH 8-9.5) -1.09 -2.45 -8.89 3 5 0 70 229.324 4
Lo Low (pH 4.5-6) -1.09 0.21 -96.12 5 5 2 73 231.34 4

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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