COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL369946
Chemical Name: 2-[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-5-nitrobenzaldehyde
Smiles: O=Cc1cc(ccc1Sc1nnc(n1CC)c1ccccc1)[N+](=O)[O-]

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Molecular Weight: 354.39
Empirical Formula: C17H14N4O3S

Physical State: Dry powder
Available Amount: 4020 mg

Lipinsky:
logP: 5.24
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 118
Number of rings: 3

     

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