UCSF

ZINC14000279

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 1st, 2008 13 Yes

Popular Name: 2-methyl-2-(4-methylphenyl)propanoic acid 2-methyl-2-(4-methylphenyl)propa…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 20430-18-6 , [20430-18-6]

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) 2.78 6.5 -48.83 0 2 -1 40 177.223 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 76 - 78 Enamine Building Blocks
MP 76...78 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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