COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL236014
Chemical Name: methyl4-[({1-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidin-4-yl}carbonyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)C1CCN(CC1)c1ccc2n(n1)c(nn2)C(F)(F)F

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Molecular Weight: 448.4
Empirical Formula: C20H19F3N6O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.798
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 101
Number of rings: 4

     

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