COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK733746
Chemical Name: 4,5-diphenyl-4H-1,2,4-triazol-3-yl(1E)-N-(3-nitrophenyl)-2-oxopropanehydrazonothioate
Smiles: CC(=O)/C(=N\Nc1cccc(c1)[N+](=O)[O-])/Sc1nnc(n1c1ccccc1)c1ccccc1

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Molecular Weight: 458.5
Empirical Formula: C23H18N6O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.836
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 143
Number of rings: 4

     

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