UCSF

ZINC04352652

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) 1.33 3.67 -14.69 0 4 0 44 204.229 3
Lo Low (pH 4.5-6) 1.33 3.95 -34.49 1 4 1 45 205.237 3
Lo Low (pH 4.5-6) 1.33 4.02 -27.28 1 4 1 45 205.237 3
Lo Low (pH 4.5-6) 1.33 4.32 -92.37 2 4 2 47 206.245 3

Vendor Notes

Note Type Comments Provided By
MP 79-82° Matrix Scientific
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.