UCSF

ZINC34619184

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 15 Yes

Popular Name: 2-(7-Methoxynaphthalen-1-yl)ethanamine 2-(7-Methoxynaphthalen-1-yl)etha…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 138113-09-4 , 139525-77-2 , [138113-09-4]

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) 2.11 4.71 -46.13 3 2 1 37 202.277 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID US5385944; US5389683; US5449689; US5449690 IBM Patent Data

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