COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK536651
Chemical Name: hexyl2-({(E)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzoate
Smiles: CCCCCCOC(=O)c1ccccc1N/C=C(/c1scc(n1)c1cc2cc(Br)ccc2oc1=O)\C#N

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Molecular Weight: 578.49
Empirical Formula: C28H24BrN3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.294
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 129
Number of rings: 4

     

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