COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK523854
Chemical Name: 2-{[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(/N=C/c2cc3OCOc3cc2Br)sc2c1CCCC2

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Molecular Weight: 389.27
Empirical Formula: C17H13BrN2O2S

Physical State: Dry powder
Available Amount: 647 mg

Lipinsky:
logP: 4.718
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 4

     

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