UCSF

ZINC36180161

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 13 Yes

Popular Name: 1-(5-Bromo-2-fluorophenyl)butan-1-one 1-(5-Bromo-2-fluorophenyl)butan-…

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CAS Numbers: 1197943-61-5 , [1197943-61-5]

Other Names:

MFCD14533632

OT-1574

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) 3.80 7.23 -7.29 0 1 0 17 245.091 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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