COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK743935
Chemical Name: 2-[(1,3-dimethyl-2,6-dioxo-7-propyl-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)acetamide
Smiles: CCCn1c(SCC(=O)Nc2c(C)ccc3c2nsn3)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 459.55
Empirical Formula: C19H21N7O3S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.63
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 166
Number of rings: 4

     

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