COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK817011
Chemical Name: 2-bromo-4-{(E)-[2-(2,3-dihydro-1,4-benzodioxin-2-yl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}-6-methoxyphenylacetate
Smiles: COc1cc(cc(c1OC(=O)C)Br)/C=c\1/sc2n(c1=O)nc(n2)C1COc2c(O1)cccc2

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Molecular Weight: 530.36
Empirical Formula: C22H16BrN3O6S

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 4.32
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 127
Number of rings: 5

     

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