COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK552938
Chemical Name: (2E)-N-(3-chlorophenyl)-2-cyano-2-{(5E)-5-[4-(hexyloxy)benzylidene]-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene}ethanamide
Smiles: CCCCCCOc1ccc(cc1)/C=c\1/s/c(=C(/C(=O)Nc2cccc(c2)Cl)\C#N)/n(c1=O)c1ccccc1

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Molecular Weight: 558.1
Empirical Formula: C31H28ClN3O3S

Physical State: Dry powder
Available Amount: 280 mg

Lipinsky:
logP: 8.317
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 4

     

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