UCSF

ZINC08701292

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) 2.68 4.7 -5.35 3 3 0 55 252.115 1
Mid Mid (pH 6-8) 2.68 4.88 -31.67 4 3 1 56 253.123 1
Mid Mid (pH 6-8) 2.68 4.71 -5.55 3 3 0 55 252.115 1

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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