COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564902
Chemical Name: (4E)-4-[(3-bromophenyl)(hydroxy)methylidene]-5-(3,4-dimethoxyphenyl)-1-hexadecylpyrrolidine-2,3-dione
Smiles: CCCCCCCCCCCCCCCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)Br)/O)/C1c1ccc(c(c1)OC)OC

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Molecular Weight: 642.67
Empirical Formula: C35H48BrNO5

Physical State: Dry powder
Available Amount: 260 mg

Lipinsky:
logP: 11.597
Rotatable bonds: 20
H-donors: 1
H-acceptors: 5
PSA: 76
Number of rings: 3

     

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