COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK308546
Chemical Name: (2E)-3-(1-methyl-1H-pyrazol-3-yl)-2-nitro-1-phenylprop-2-en-1-one
Smiles: Cn1ccc(n1)/C=C(\C(=O)c1ccccc1)/[N+](=O)[O-]

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Molecular Weight: 257.25
Empirical Formula: C13H11N3O3

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 1.436
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 80
Number of rings: 2

     

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