COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK800919
Chemical Name: (3Z)-5-bromo-3-[2-(3,4-dimethoxyphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1-ethyl-1,3-dihydro-2H-indol-2-one
Smiles: CCN1c2ccc(cc2/C(=c\2/sc3n(c2=O)nc(n3)c2ccc(c(c2)OC)OC)/C1=O)Br

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Molecular Weight: 513.37
Empirical Formula: C22H17BrN4O4S

Physical State: Dry powder
Available Amount: 395 mg

Lipinsky:
logP: 4.793
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 111
Number of rings: 5

     

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