COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK725821
Chemical Name: benzyl{[3-cyano-4-(4-hydroxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Smiles: N#CC1=C(SCC(=O)OCc2ccccc2)NC(=O)CC1c1ccc(cc1)O

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Molecular Weight: 394.45
Empirical Formula: C21H18N2O4S

Physical State: Dry powder
Available Amount: 142 mg

Lipinsky:
logP: 4.144
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 124
Number of rings: 3

     

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