COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL005404
Chemical Name: 5-(3-ethoxyphenyl)-4-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1cccc(c1)c1nnc(n1/N=C/C=C/c1ccccc1[N+](=O)[O-])S

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Molecular Weight: 395.44
Empirical Formula: C19H17N5O3S

Available Amount: 0 mg

Lipinsky:
logP: 6.058
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 136
Number of rings: 3

     

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