COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK014825
Chemical Name: (2Z)-3-{2-bromo-4-[(2-chlorobenzyl)oxy]-5-methoxyphenyl}-2-phenylprop-2-enenitrile
Smiles: N#C/C(=C\c1cc(OC)c(cc1Br)OCc1ccccc1Cl)/c1ccccc1

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Molecular Weight: 454.75
Empirical Formula: C23H17BrClNO2

Physical State: Dry powder
Available Amount: 341 mg

Lipinsky:
logP: 7.714
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 42
Number of rings: 3

     

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