COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK537008
Chemical Name: methyl2-({(E)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-4,5-dimethoxybenzoate
Smiles: N#C/C(=C\Nc1cc(OC)c(cc1C(=O)OC)OC)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

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Molecular Weight: 568.4
Empirical Formula: C25H18BrN3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.883
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 148
Number of rings: 4

     

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