COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL002068
Chemical Name: 5-[4-(dimethylamino)phenyl]-4-{[(E)-(2-nitrophenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: CN(c1ccc(cc1)c1nnc(n1/N=C/c1ccccc1[N+](=O)[O-])S)C

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Molecular Weight: 368.42
Empirical Formula: C17H16N6O2S

Available Amount: 0 mg

Lipinsky:
logP: 5.349
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 130
Number of rings: 3

     

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