COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK552626
Chemical Name: 4-{(Z)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}-2,6-dimethoxyphenylacetate
Smiles: N#C/C(=C/c1cc(OC)c(c(c1)OC)OC(=O)C)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

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Molecular Weight: 553.39
Empirical Formula: C25H17BrN2O6S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.727
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 135
Number of rings: 4

     

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