COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK047926
Chemical Name: ethyl2-{[(E)-(5-benzyl-3-bromo-2-hydroxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(/N=C/c2cc(Cc3ccccc3)cc(c2O)Br)sc2c1CCCC2

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Molecular Weight: 498.44
Empirical Formula: C25H24BrNO3S

Physical State: Dry powder
Available Amount: 170 mg

Lipinsky:
logP: 8.913
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 87
Number of rings: 4

     

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