COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK887381
Chemical Name: 4-(1,3-benzodioxol-5-yl)-6-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(SCC(=O)c2ccccc2)NC(=O)CC1c1ccc2c(c1)OCO2

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Molecular Weight: 392.44
Empirical Formula: C21H16N2O4S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.229
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 4

     

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