COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL287752
Chemical Name: 3-methyl-4-[4-(methylsulfanyl)phenyl]-1-(9H-purin-6-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: CSc1ccc(cc1)C1SCC(=O)Nc2c1c(C)nn2c1ncnc2c1nc[nH]2

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Molecular Weight: 423.52
Empirical Formula: C19H17N7OS2

Available Amount: 0 mg

Lipinsky:
logP: 3.883
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 151
Number of rings: 5

     

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