UCSF

ZINC00157213

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 Yes

Popular Name: 2-Acetyl-4-butyramidophenol 2-Acetyl-4-butyramidophenol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 40188-45-2 , [40188-45-2]

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) 2.37 -0.49 -13.86 2 4 0 66 221.256 4 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 124-126? Alfa-Aesar
Melting_Point 124-126° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

Activity (Go SEA)

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