UCSF

ZINC00153888

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 14 No

Popular Name: 1-(3-Fluorophenyl)-2-methylsulfonylethanone 1-(3-Fluorophenyl)-2-methylsulfo…

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CAS Numbers: 82652-12-8 , [82652-12-8]

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) 1.00 2.86 -24.82 0 3 0 51 216.233 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 81-83° Matrix Scientific
Purity 95%+ Fluorochem
Warnings Irritant Matrix Scientific

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

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