UCSF

ZINC00284529

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 12 Yes

Popular Name: 4-Bromo-1-phenyl-1H-pyrazole 4-Bromo-1-phenyl-1H-pyrazole

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CAS Numbers: 15115-52-3 , N/A , [15115-52-3]

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) 2.40 1.18 -5.6 0 2 0 18 223.073 1 ↓

Vendor Notes

Note Type Comments Provided By
mp 250 MolMall (formerly Molecular Diversity Preservation International)
MP 78-79° Matrix Scientific
Purity 95% Fluorochem
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific

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