COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK702498
Chemical Name: ethyl4-({[(3Z)-3-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-2-oxo-2,3-dihydro-1H-indol-1-yl]acetyl}amino)benzoate
Smiles: CCCCCCN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2)C(=O)OCC)/C1=O

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Molecular Weight: 551.69
Empirical Formula: C28H29N3O5S2

Physical State: Dry powder
Available Amount: 402 mg

Lipinsky:
logP: 4.889
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 153
Number of rings: 4

     

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