UCSF

ZINC13331529

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Substance Information

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

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

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CAS Numbers: 925580-76-3 , [925580-76-3]

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) 2.17 6.73 -8.23 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% )