COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK552613
Chemical Name: (2Z)-3-[4-(benzyloxy)-3-methoxyphenyl]-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/c1ccc(c(c1)OC)OCc1ccccc1)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

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Molecular Weight: 571.45
Empirical Formula: C29H19BrN2O4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 7.123
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 109
Number of rings: 5

     

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