COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL007047
Chemical Name: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-oxobutan-2-yl)sulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile
Smiles: N#Cc1c(SC(C(=O)C)C)nc(cc1C(F)(F)F)c1ccc2c(c1)OCCO2

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Molecular Weight: 408.4
Empirical Formula: C19H15F3N2O3S

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 4.336
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 97
Number of rings: 3

     

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