COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL473596
Chemical Name: 2-{2-[4-(methylsulfonyl)piperazin-1-yl]-2-oxoethyl}-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Smiles: O=C(N1CCN(CC1)S(=O)(=O)C)Cn1nc2CCCCCc2cc1=O

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Molecular Weight: 368.46
Empirical Formula: C16H24N4O4S

Available Amount: 0 mg

Lipinsky:
logP: -0.367
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 98
Number of rings: 3

     

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