COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK702922
Chemical Name: ethyl4-[({(3Z)-3-[3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CN1c2ccccc2/C(=C\2/SC(=S)N(C2=O)c2c(C)n(n(c2=O)c2ccccc2)C)/C1=O

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Molecular Weight: 653.74
Empirical Formula: C33H27N5O6S2

Physical State: Dry powder
Available Amount: 405 mg

Lipinsky:
logP: 3.436
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 176
Number of rings: 6

     

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