COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK535366
Chemical Name: 5-(2,4-dichlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl(1E)-N-(3-nitrophenyl)-2-oxopropanehydrazonothioate
Smiles: Clc1ccc(c(c1)Cl)c1nnc(n1c1ccccc1)S/C(=N/Nc1cccc(c1)[N+](=O)[O-])/C(=O)C

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Molecular Weight: 527.39
Empirical Formula: C23H16Cl2N6O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.786
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 143
Number of rings: 4

     

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