COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL372589
Chemical Name: 4-[(3-{(E)-[1-(2-methoxyethyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-1H-indol-1-yl)methyl]benzonitrile
Smiles: COCCN1C(=S)NC(=O)/C(=C\c2cn(c3c2cccc3)Cc2ccc(cc2)C#N)/C1=O

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Molecular Weight: 444.51
Empirical Formula: C24H20N4O3S

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 2.979
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 119
Number of rings: 4

     

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