COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK706069
Chemical Name: (5Z)-2-(2-methylphenyl)-5-{[3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: Cc1ccccc1c1nn2c(n1)s/c(=C\c1cn(nc1c1ccc(cc1)[N+](=O)[O-])c1ccccc1)/c2=O

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Molecular Weight: 506.54
Empirical Formula: C27H18N6O3S

Physical State: Dry powder
Available Amount: 402 mg

Lipinsky:
logP: 7.203
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 136
Number of rings: 6

     

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