COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL251367
Chemical Name: 1-(azepan-1-yl)-4-[6-(3,5-dimethyl-1H-pyrazol-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]butan-1-one
Smiles: O=C(N1CCCCCC1)CCCc1nnc2n1nc(cc2)n1nc(cc1C)C

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Molecular Weight: 381.48
Empirical Formula: C20H27N7O

Physical State: Dry powder
Available Amount: 234 mg

Lipinsky:
logP: 2.6
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 81
Number of rings: 4

     

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