COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL093737
Chemical Name: 2-[(3-butyl-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(5-ethoxy-1,3-benzothiazol-2-yl)acetamide
Smiles: CCCCn1c(SCC(=O)Nc2sc3c(n2)cc(cc3)OCC)nc2c(c1=O)[nH]c(c2)C

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Molecular Weight: 471.6
Empirical Formula: C22H25N5O3S2

Physical State: Dry powder
Available Amount: 81 mg

Lipinsky:
logP: 4.306
Rotatable bonds: 8
H-donors: 2
H-acceptors: 3
PSA: 153
Number of rings: 4

     

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