COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK932946
Chemical Name: (4E)-4-{[(4-bromo-2-fluorophenyl)amino]methylidene}-5-methyl-2-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Brc1ccc(c(c1)F)N/C=C/1\C(=NN(C1=O)c1ccc2n(n1)cnn2)C

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Molecular Weight: 416.21
Empirical Formula: C16H11BrFN7O

Physical State: Dry powder
Available Amount: 319 mg

Lipinsky:
logP: 1.042
Rotatable bonds: 0
H-donors: 1
H-acceptors: 1
PSA: 87
Number of rings: 4

     

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