COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK549366
Chemical Name: methyl(2E)-{(2Z)-2-[1-cyano-2-oxo-2-(piperidin-1-yl)ethylidene]-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene}ethanoate
Smiles: N#C/C(=c\1/s/c(=C/C(=O)OC)/c(=O)n1c1ccccc1)/C(=O)N1CCCCC1

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Molecular Weight: 397.45
Empirical Formula: C20H19N3O4S

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 1.157
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 116
Number of rings: 3

     

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