COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL422094
Chemical Name: 4-(6-chloro[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1-[4-(methylsulfonyl)piperazin-1-yl]butan-1-one
Smiles: O=C(N1CCN(CC1)S(=O)(=O)C)CCCc1nnc2n1nc(Cl)cc2

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Molecular Weight: 386.86
Empirical Formula: C14H19ClN6O3S

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 0.207
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 109
Number of rings: 3

     

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