UCSF

ZINC33487185

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 10th, 2009 13 Yes

Popular Name: 2-(3-bromophenyl)-2-methylpropanoic acid 2-(3-bromophenyl)-2-methylpropan…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 81606-47-5 , N/A , [81606-47-5]

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) 3.12 6.46 -47.79 0 2 -1 40 242.092 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 68 - 70 Enamine Building Blocks
MP 68...70 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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