COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK023220
Chemical Name: 8-[(3-chloro-2-hydroxypropyl)sulfanyl]-3-methyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(SCC(CCl)O)nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 332.81
Empirical Formula: C12H17ClN4O3S

Physical State: Dry powder
Available Amount: 369 mg

Lipinsky:
logP: 1.763
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 112
Number of rings: 2

     

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