COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK897601
Chemical Name: 3-[(9-benzyl-1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)sulfonyl]propanoicacid
Smiles: OC(=O)CCS(=O)(=O)c1nc2c(n1Cc1ccccc1)n(C)c(=O)n(c2=O)C

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Molecular Weight: 406.42
Empirical Formula: C17H18N4O6S

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 1.284
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 138
Number of rings: 3

     

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