UCSF

ZINC04131901

Annotations

Vendors

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) 1.90 6.39 -49.64 2 5 1 66 242.686 2
Hi High (pH 8-9.5) 1.90 5.02 -4.54 1 5 0 61 241.678 2
Hi High (pH 8-9.5) 2.38 9.29 -12.95 1 9 0 94 393.451 5

Vendor Notes

Note Type Comments Provided By
MP 105-106° Fluorochem
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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