UCSF

ZINC00468332

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 17 Yes

Popular Name: 3-Methyl-2-(4-methyl-benzoylamino)-butyric acid 3-Methyl-2-(4-methyl-benzoylamin…

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CAS Numbers: 1212283-70-9 , 323587-86-6

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) 0.48 5.92 -57.25 1 4 -1 69 234.275 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 155 - 157 Enamine Building Blocks
MP 155...157 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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