COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK585147
Chemical Name: 8-(4-benzylpiperidin-1-yl)-6-hydroxy-3-methyl-7-{3-[(4-methylpyrimidin-2-yl)sulfanyl]propyl}-3,7-dihydro-2H-purin-2-one
Smiles: Cc1ccnc(n1)SCCCn1c(nc2c1c(O)nc(=O)n2C)N1CCC(CC1)Cc1ccccc1

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Molecular Weight: 505.64
Empirical Formula: C26H31N7O2S

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 3.57
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 125
Number of rings: 5

     

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