UCSF

ZINC00394644

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) 0.85 1.97 -9.11 2 2 0 43 135.166 2

Vendor Notes

Note Type Comments Provided By
MP 156 TCI
MP 156° Fluorochem
Purity 99% Fluorochem
UniProt Database Links AAM_RHOER; CP51_MYCTU; EST4_RAT; MANHY_PSEPU; PAO_PSESP ChEBI
Patent Database Links GB2311066; US2006079506; WO2005039506; WO2005047249; WO2005058844; WO2005075471; WO2005077050; WO2005092860; WO2005123050; WO2006027252; WO2006110917; WO2006136823; WO2008130348 ChEBI
Warnings IRRITANT Matrix Scientific
Warnings Irritant-Harmful Matrix Scientific

Activity (Go SEA)

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

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