COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL478579
Chemical Name: 4-bromo-2,6-dimethylphenyl(2Z)-3-(4-butoxyphenyl)-2-cyanoprop-2-enoate
Smiles: CCCCOc1ccc(cc1)/C=C(\C(=O)Oc1c(C)cc(cc1C)Br)/C#N

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Molecular Weight: 428.33
Empirical Formula: C22H22BrNO3

Available Amount: 0 mg

Lipinsky:
logP: 7.192
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 59
Number of rings: 2

     

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