COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK262743
Chemical Name: 7-benzyl-1,3-dimethyl-8-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C(c1cccs1)N1CCN(CC1)c1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

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Molecular Weight: 464.55
Empirical Formula: C23H24N6O3S

Physical State: Dry powder
Available Amount: 212 mg

Lipinsky:
logP: 1.956
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 110
Number of rings: 5

     

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