UCSF

ZINC02555530

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 13 Yes

Popular Name: Benzyl(3-methoxypropyl)amine Benzyl(3-methoxypropyl)amine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1158456-03-1 , 32857-21-9 , [32857-21-9]

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) 1.75 5.1 -40.82 2 2 1 26 180.271 6 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
PUBCHEM_PATENT_ID US3954399; US4918074 IBM Patent Data

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