COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL487717
Chemical Name: 3,5-dimethyl-1-{1-[4-(methylsulfanyl)phenyl]-2-nitroethyl}-1H-pyrazole
Smiles: CSc1ccc(cc1)C(n1nc(cc1C)C)C[N+](=O)[O-]

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Molecular Weight: 291.37
Empirical Formula: C14H17N3O2S

Available Amount: 0 mg

Lipinsky:
logP: 3.558
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 88
Number of rings: 2

     

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