COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK985670
Chemical Name: N-(1,3-benzodioxol-5-yl)-2-{[5-(4-ethoxyphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCO3)nc2c(c1=O)cn[nH]2

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Molecular Weight: 465.49
Empirical Formula: C22H19N5O5S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 3.017
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 143
Number of rings: 5

     

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