COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK528806
Chemical Name: {[3-methyl-2,6-dioxo-7-(prop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}aceticacid
Smiles: C=CCn1c(SCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 296.31
Empirical Formula: C11H12N4O4S

Physical State: Dry powder
Available Amount: 319 mg

Lipinsky:
logP: 1.095
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 129
Number of rings: 2

     

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