COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK801055
Chemical Name: (3Z)-5-bromo-1-ethyl-3-[2-(2-methoxyphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1,3-dihydro-2H-indol-2-one
Smiles: COc1ccccc1c1nc2n(n1)c(=O)/c(=C\1/C(=O)N(c3c1cc(Br)cc3)CC)/s2

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Molecular Weight: 483.35
Empirical Formula: C21H15BrN4O3S

Physical State: Dry powder
Available Amount: 395 mg

Lipinsky:
logP: 4.285
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 102
Number of rings: 5

     

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