COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK935152
Chemical Name: (4E)-4-{[(2,4-dichlorophenyl)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: Clc1ccc(c(c1)Cl)N/C=C/1\C(=NN(C1=O)c1ccc2n(n1)c(nn2)C(F)(F)F)C

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Molecular Weight: 456.21
Empirical Formula: C17H10Cl2F3N7O

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.699
Rotatable bonds: 0
H-donors: 1
H-acceptors: 1
PSA: 87
Number of rings: 4

     

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