COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473349
Chemical Name: {[1-(3-chlorobenzyl)-3-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methylidene}propanedinitrile
Smiles: N#CC(=Cc1cn(nc1c1ccc(c(c1)OC)OC)Cc1cccc(c1)Cl)C#N

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Molecular Weight: 404.86
Empirical Formula: C22H17ClN4O2

Physical State: Dry powder
Available Amount: 209 mg

Lipinsky:
logP: 3.525
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 83
Number of rings: 3

     

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