COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK103298
Chemical Name: (2-bromo-4-{(E)-[(2E)-3-ethyl-2-{[4-(methoxycarbonyl)phenyl]imino}-4-oxo-1,3-thiazolidin-5-ylidene]methyl}-6-methoxyphenoxy)aceticacid
Smiles: CCN1/C(=N\c2ccc(cc2)C(=O)OC)/S/C(=C/c2cc(Br)c(c(c2)OC)OCC(=O)O)/C1=O

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Molecular Weight: 549.4
Empirical Formula: C23H21BrN2O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.111
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 140
Number of rings: 3

     

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