COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK815532
Chemical Name: (5Z)-5-(5-bromo-2-methoxybenzylidene)-2-(4-butoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: CCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1cc(Br)ccc1OC)/c2=O

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Molecular Weight: 486.39
Empirical Formula: C22H20BrN3O3S

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 7.93
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 91
Number of rings: 4

     

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