COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK099757
Chemical Name: (5Z)-5-{2-[2-(4-tert-butylphenoxy)ethoxy]-5-chlorobenzylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1NC(=O)/C(=C/c2cc(Cl)ccc2OCCOc2ccc(cc2)C(C)(C)C)/S1

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Molecular Weight: 448.01
Empirical Formula: C22H22ClNO3S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.812
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 104
Number of rings: 3

     

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