COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK000855
Chemical Name: 3-{[7-(4-chlorobenzyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}propanoicacid
Smiles: OC(=O)CCSc1nc2c(n1Cc1ccc(cc1)Cl)c(=O)[nH]c(=O)n2C

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Molecular Weight: 394.84
Empirical Formula: C16H15ClN4O4S

Available Amount: 0 mg

Lipinsky:
logP: 2.808
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 129
Number of rings: 3

     

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