COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK941779
Chemical Name: (4E)-4-{[(2-chlorophenyl)amino]methylidene}-5-methyl-2-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C/Nc1ccccc1Cl)c1ccc2n(n1)c(nn2)C(F)(F)F

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Molecular Weight: 421.77
Empirical Formula: C17H11ClF3N7O

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.696
Rotatable bonds: 0
H-donors: 1
H-acceptors: 1
PSA: 87
Number of rings: 4

     

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