COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL497349
Chemical Name: methyl({5-cyano-4-[4-(dimethylamino)phenyl]-6-oxo-1,6-dihydropyrimidin-2-yl}sulfanyl)acetate
Smiles: COC(=O)CSc1nc(c2ccc(cc2)N(C)C)c(c(=O)[nH]1)C#N

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Molecular Weight: 344.39
Empirical Formula: C16H16N4O3S

Physical State: Dry powder
Available Amount: 157 mg

Lipinsky:
logP: 2.008
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 120
Number of rings: 2

     

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