COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK209086
Chemical Name: methyl4-({2-[(5-benzyl-4-hydroxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]propanoyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)C(Sc1nc(O)c(c(=O)[nH]1)Cc1ccccc1)C

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Molecular Weight: 439.49
Empirical Formula: C22H21N3O5S

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 4.497
Rotatable bonds: 6
H-donors: 3
H-acceptors: 5
PSA: 142
Number of rings: 3

     

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