COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK551528
Chemical Name: (2E)-N-(4-butylphenyl)-2-[5-(3-chlorobenzyl)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyanoethanamide
Smiles: CCCCc1ccc(cc1)NC(=O)/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1cccc(c1)Cl)/C#N

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Molecular Weight: 516.06
Empirical Formula: C29H26ClN3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.786
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 98
Number of rings: 4

     

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