UCSF

ZINC08227276

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 5th, 2006 11 Yes

Popular Name: N-ethyl-4-fluorobenzylamine N-ethyl-4-fluorobenzylamine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 119744-61-5 , 162401-03-8 , [119744-61-5]

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) 2.04 0.78 -42.12 2 1 1 17 154.208 3 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0645390A1; US5618814 IBM Patent Data

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