COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK527143
Chemical Name: N-[(E)-{3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]-4H-1,2,4-triazol-3-amine
Smiles: COc1ccc(cc1Cn1nc(c(c1C)[N+](=O)[O-])C)/C=N/c1nnc[nH]1

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Molecular Weight: 355.36
Empirical Formula: C16H17N7O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.239
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 126
Number of rings: 3

     

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