COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK574969
Chemical Name: (5Z)-5-benzylidene-3-{2-oxo-2-[2-(pyridin-3-yl)piperidin-1-yl]ethyl}-2-thioxo-1,3-thiazolidin-4-one
Smiles: O=C(N1CCCCC1c1cccnc1)CN1C(=S)S/C(=C\c2ccccc2)/C1=O

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Molecular Weight: 423.56
Empirical Formula: C22H21N3O2S2

Physical State: Dry powder
Available Amount: 233 mg

Lipinsky:
logP: 2.821
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 110
Number of rings: 4

     

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