COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL168422
Chemical Name: 2-[(E)-(2-{5-[(3,4-dichlorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}hydrazinylidene)methyl]-4-nitrophenol
Smiles: Oc1ccc(cc1/C=N/Nc1nnc([nH]1)SCc1ccc(c(c1)Cl)Cl)[N+](=O)[O-]

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Molecular Weight: 439.28
Empirical Formula: C16H12Cl2N6O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.543
Rotatable bonds: 6
H-donors: 3
H-acceptors: 3
PSA: 157
Number of rings: 3

     

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