COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382240
Chemical Name: (2E,5Z)-3-ethyl-5-[(7-methoxy-1,3-benzodioxol-5-yl)methylidene]-2-{[4-(piperidin-1-yl)phenyl]imino}-1,3-thiazolidin-4-one
Smiles: CCN1/C(=N\c2ccc(cc2)N2CCCCC2)/S/C(=C\c2cc(OC)c3c(c2)OCO3)/C1=O

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Molecular Weight: 465.57
Empirical Formula: C25H27N3O4S

Physical State: Dry powder
Available Amount: 177 mg

Lipinsky:
logP: 6.084
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 88
Number of rings: 5

     

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