COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK188078
Chemical Name: 2-[(3-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-1-yl)methyl]benzonitrile
Smiles: C=CCN1C(=S)NC(=O)/C(=C\c2cn(c3c2cccc3)Cc2ccccc2C#N)/C1=O

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Molecular Weight: 426.5
Empirical Formula: C24H18N4O2S

Physical State: Dry powder
Available Amount: 69 mg

Lipinsky:
logP: 3.835
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 110
Number of rings: 4

     

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