COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL505077
Chemical Name: 2-{[(3Z)-5-bromo-1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]amino}-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: CCN1C(=O)/C(=N\c2sc3c(c2C#N)CCC(C3)C(C)(C)C)/c2c1ccc(c2)Br

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Molecular Weight: 470.43
Empirical Formula: C23H24BrN3OS

Physical State: Dry powder
Available Amount: 628 mg

Lipinsky:
logP: 7.326
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 84
Number of rings: 4

     

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