UCSF

ZINC00001309

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) 3.58 8.93 -11.39 0 5 0 53 304.352 7

Vendor Notes

Note Type Comments Provided By
UniProt Database Links AK2E4_BOMMO ChEBI
Patent Database Links EP1661886; EP1700845; US2004053786; US2004235959; US2005085457; US2006019947; US2006057101; US2006111403; US2006178372; US2007027154; US2007225336; US2007264299; US2007269467; US2008275061; WO2005118552; WO2006023783; WO2006055922; WO2007089330; WO2008150 ChEBI
Therapy insecticide, cholinesterase inhibitor SMDC Pharmakon

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

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