COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047213
Chemical Name: 3-{[6-hydroxy-3-methyl-2-oxo-7-(prop-2-en-1-yl)-3,7-dihydro-2H-purin-8-yl]sulfanyl}propanoicacid
Smiles: C=CCn1c(SCCC(=O)O)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 310.33
Empirical Formula: C12H14N4O4S

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 0.914
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 133
Number of rings: 2

     

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