COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK815944
Chemical Name: (5Z)-2-(4-butoxyphenyl)-5-(4-tert-butylbenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: CCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1ccc(cc1)C(C)(C)C)/c2=O

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Molecular Weight: 433.57
Empirical Formula: C25H27N3O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 8.52
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 4

     

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