UCSF

ZINC00449515

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 15 No

Popular Name: N-(5-Chloro-2-methyl-phenyl)-3-oxo-butyramide N-(5-Chloro-2-methyl-phenyl)-3-o…

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CAS Number: 25233-50-5

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) 1.99 6.82 -18.03 1 3 0 46 225.675 3 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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