COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK654171
Chemical Name: 4-(2,4-dichlorophenyl)-3-methyl-1-(9H-purin-6-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: Clc1ccc(c(c1)Cl)C1SCC(=Nc2c1c(C)nn2c1ncnc2c1nc[nH]2)O

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Molecular Weight: 446.32
Empirical Formula: C18H13Cl2N7OS

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 3.706
Rotatable bonds: 2
H-donors: 2
H-acceptors: 1
PSA: 130
Number of rings: 5

     

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