COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK362290
Chemical Name: (2E)-2-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1-benzothiophen-3(2H)-one
Smiles: Brc1cc2OCOc2cc1/C=C\1/Sc2c(C1=O)cccc2

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Molecular Weight: 361.22
Empirical Formula: C16H9BrO3S

Physical State: Dry powder
Available Amount: 187 mg

Lipinsky:
logP: 4.732
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 60
Number of rings: 4

     

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