COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK123165
Chemical Name: 2-({2-ethoxy-4-[(Z)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzonitrile
Smiles: CCCN1C(=S)S/C(=C\c2ccc(c(c2)OCC)OCc2ccccc2C#N)/C1=O

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Molecular Weight: 438.57
Empirical Formula: C23H22N2O3S2

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 4.381
Rotatable bonds: 8
H-donors: 0
H-acceptors: 3
PSA: 119
Number of rings: 3

     

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