COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK025384
Chemical Name: (4E)-4-[(4-bromo-5-iodofuran-2-yl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C/c1cc(c(o1)I)Br)c1ccccc1

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Molecular Weight: 457.07
Empirical Formula: C15H10BrIN2O2

Physical State: Dry powder
Available Amount: 241 mg

Lipinsky:
logP: 5.042
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 45
Number of rings: 3

     

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