COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK516591
Chemical Name: (5Z)-2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: COc1cc(/C=C/c2nn3c(n2)s/c(=C\c2cn(nc2c2ccc(cc2)F)c2ccccc2)/c3=O)ccc1OC

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Molecular Weight: 551.6
Empirical Formula: C30H22FN5O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 7.43
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 109
Number of rings: 6

     

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