COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK904948
Chemical Name: (5Z)-2-(4-butoxyphenyl)-5-({3-[4-(3-methylbutoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: CCCCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1cn(nc1c1ccc(cc1)OCCC(C)C)c1ccccc1)/s2

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Molecular Weight: 605.76
Empirical Formula: C35H35N5O3S

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 10.644
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 109
Number of rings: 6

     

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