COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK685150
Chemical Name: 6-oxo-4-phenyl-2-{[(E)-2'H-spiro[cyclopentane-1,3'-isoquinolin]-1'(4'H)-ylidenemethyl]sulfanyl}-1,6-dihydropyrimidine-5-carbonitrile
Smiles: N#Cc1c(=O)[nH]c(nc1c1ccccc1)S/C=C\1/NC2(CCCC2)Cc2c1cccc2

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Molecular Weight: 426.54
Empirical Formula: C25H22N4OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.182
Rotatable bonds: 2
H-donors: 2
H-acceptors: 1
PSA: 102
Number of rings: 5

     

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