COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741664
Chemical Name: 4-{[(E)-(3-bromo-2-hydroxy-5-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: Brc1cc(cc(c1O)/C=N/c1c(C)n(n(c1=O)c1ccccc1)C)[N+](=O)[O-]

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Molecular Weight: 431.25
Empirical Formula: C18H15BrN4O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.52
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 101
Number of rings: 3

     

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