COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK097012
Chemical Name: 2-{[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile
Smiles: N#Cc1c(C)cc(nc1SCC(=O)c1ccc2c(c1)OCO2)C

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Molecular Weight: 326.38
Empirical Formula: C17H14N2O3S

Physical State: Dry powder
Available Amount: 48 mg

Lipinsky:
logP: 3.099
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 97
Number of rings: 3

     

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