COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK985710
Chemical Name: N-(3-chloro-4-fluorobenzyl)-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)NCc2ccc(c(c2)Cl)F)nc2c(c1=O)cn[nH]2

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Molecular Weight: 487.94
Empirical Formula: C22H19ClFN5O3S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 3.323
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 124
Number of rings: 4

     

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