COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK702943
Chemical Name: 2-[(1-{3-[(5Z)-5-(4-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}-1H-benzimidazol-2-yl)sulfanyl]-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nc2c(n1C(=O)CCN1C(=S)S/C(=C\c3ccc(cc3)Cl)/C1=O)cccc2

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Molecular Weight: 637.2
Empirical Formula: C30H25ClN4O4S3

Physical State: Dry powder
Available Amount: 399 mg

Lipinsky:
logP: 6.376
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 176
Number of rings: 5

     

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