COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK612444
Chemical Name: (5E)-5-benzylidene-3-{3-[2-(2-hydroxyethyl)piperidin-1-yl]-3-oxopropyl}-2-thioxo-1,3-thiazolidin-4-one
Smiles: OCCC1CCCCN1C(=O)CCN1C(=S)S/C(=C/c2ccccc2)/C1=O

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Molecular Weight: 404.55
Empirical Formula: C20H24N2O3S2

Physical State: Dry powder
Available Amount: 296 mg

Lipinsky:
logP: 2.006
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 118
Number of rings: 3

     

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