UCSF

ZINC04207406

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 12 Yes

Popular Name: (S)-1-(4-Fluorophenyl)-2-methylpropan-1-amine hydrochloride (S)-1-(4-Fluorophenyl)-2-methylp…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1213329-40-8 , 1213352-15-8 , 1803588-71-7 , 863668-04-6 , [1213352-15-8] , [863668-04-6]

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) 0.71 4.56 -47.37 3 1 1 28 168.235 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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