COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK818512
Chemical Name: (5Z)-5-(2-chloro-6-fluorobenzylidene)-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: CCCCCCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1c(F)cccc1Cl)/s2

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Molecular Weight: 457.96
Empirical Formula: C23H21ClFN3O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 7.888
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 4

     

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