COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK538190
Chemical Name: methyl2-{[(E)-(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COc1cc(Br)cc(c1O)/C=N/c1sc2c(c1C(=O)OC)CCCC2

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Molecular Weight: 424.32
Empirical Formula: C18H18BrNO4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.408
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 96
Number of rings: 3

     

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