COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK751808
Chemical Name: 4-{[(E)-(4,5-dimethoxy-2-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: COc1cc(/C=N/c2c(C)n(n(c2=O)c2ccccc2)C)c(cc1OC)[N+](=O)[O-]

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Molecular Weight: 396.4
Empirical Formula: C20H20N4O5

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 2.979
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 100
Number of rings: 3

     

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