UCSF

ZINC00409325

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 9 Yes

Popular Name: N,N-diethylpropionamide N,N-diethylpropionamide

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1114-51-8 , [1114-51-8]

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) 1.29 1.64 -7.3 0 2 0 20 129.203 3 ↓

Vendor Notes

Note Type Comments Provided By
BP 191 TCI
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0086301A1; US4493835; US5332757; WO1999009027A1 IBM Patent Data

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