COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK766896
Chemical Name: 2-[(7-butyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-N-{4-[chloro(difluoro)methoxy]phenyl}acetamide
Smiles: CCCCn1c(SCC(=O)Nc2ccc(cc2)OC(Cl)(F)F)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 501.94
Empirical Formula: C20H22ClF2N5O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.157
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 122
Number of rings: 3

     

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