COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK904875
Chemical Name: (5Z)-2-(4-butoxyphenyl)-5-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: CCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1cn(nc1c1cccc(c1)[N+](=O)[O-])c1ccccc1)/c2=O

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Molecular Weight: 564.62
Empirical Formula: C30H24N6O4S

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 8.417
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 145
Number of rings: 6

     

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