COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK262727
Chemical Name: 4-(7-benzyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-N-(2-methoxyethyl)piperazine-1-carbothioamide
Smiles: COCCNC(=S)N1CCN(CC1)c1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

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Molecular Weight: 471.58
Empirical Formula: C22H29N7O3S

Physical State: Dry powder
Available Amount: 187 mg

Lipinsky:
logP: 0.87
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 118
Number of rings: 4

     

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