UCSF

ZINC00399787

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 7 Yes

Popular Name: 2-methylbutanamide 2-methylbutanamide

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1113-57-1 , 389122-94-5

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) 0.67 0.28 -7.11 2 2 0 43 101.149 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
PUBCHEM_PATENT_ID WO2000031038A1 IBM Patent Data

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