COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK728484
Chemical Name: (2Z)-2-(4-bromo-3-nitrobenzylidene)-1-benzothiophen-3(2H)-one
Smiles: [O-][N+](=O)c1cc(ccc1Br)/C=C/1\Sc2c(C1=O)cccc2

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Molecular Weight: 362.2
Empirical Formula: C15H8BrNO3S

Physical State: Dry powder
Available Amount: 554 mg

Lipinsky:
logP: 4.298
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 88
Number of rings: 3

     

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