COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK060711
Chemical Name: 4-bromo-N-{[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamothioyl}benzamide
Smiles: CCC(C1CCc2c(C1)sc(c2C#N)NC(=S)NC(=O)c1ccc(cc1)Br)(C)C

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Molecular Weight: 490.49
Empirical Formula: C22H24BrN3OS2

Physical State: Dry powder
Available Amount: 143 mg

Lipinsky:
logP: 7.617
Rotatable bonds: 2
H-donors: 2
H-acceptors: 1
PSA: 125
Number of rings: 3

     

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