COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431203
Chemical Name: (2Z)-2-[3,5-dibromo-2-(prop-2-en-1-yloxy)benzylidene]-1-benzothiophen-3(2H)-one
Smiles: C=CCOc1c(Br)cc(cc1/C=C/1\Sc2c(C1=O)cccc2)Br

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Molecular Weight: 452.17
Empirical Formula: C18H12Br2O2S

Physical State: Dry powder
Available Amount: 218 mg

Lipinsky:
logP: 6.196
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 51
Number of rings: 3

     

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