COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374261
Chemical Name: 4-{[(2E,5Z)-5-{5-bromo-2-[(2-cyanobenzyl)oxy]benzylidene}-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoicacid
Smiles: N#Cc1ccccc1COc1ccc(cc1/C=C/1\S/C(=N/c2ccc(cc2)C(=O)O)/N(C1=O)C)Br

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Molecular Weight: 548.42
Empirical Formula: C26H18BrN3O4S

Physical State: Dry powder
Available Amount: 1180 mg

Lipinsky:
logP: 6.681
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 128
Number of rings: 4

     

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