COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK603021
Chemical Name: (5Z)-5-benzylidene-3-(2-oxo-2-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}ethyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: O=C(N1CCN(CC1)CCc1ccccn1)CN1C(=S)S/C(=C\c2ccccc2)/C1=O

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Molecular Weight: 452.6
Empirical Formula: C23H24N4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.036
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 114
Number of rings: 4

     

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