UCSF

ZINC13331538

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 17th, 2008 15 Yes

Popular Name: 1-[1-(3-Chlorophenyl)-1H-pyrazol-4-yl]ethanone 1-[1-(3-Chlorophenyl)-1H-pyrazol…

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CAS Numbers: 925142-81-0 , [925142-81-0]

Download: MOL2 SDF SMILES Flexibase

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) 2.35 6.72 -9.46 0 3 0 35 220.659 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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