COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK096367
Chemical Name: methyl3-({[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Smiles: COC(=O)c1cccc(c1)NC(=O)CSc1nc(c2ccccc2)c(c(=O)[nH]1)C#N

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Molecular Weight: 420.45
Empirical Formula: C21H16N4O4S

Physical State: Dry powder
Available Amount: 139 mg

Lipinsky:
logP: 2.785
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 145
Number of rings: 3

     

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