COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL317046
Chemical Name: 2-({4-[(4-methoxyphenyl)sulfonyl]piperazin-1-yl}methyl)-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)Cn1nc2CCCCCc2cc1=O

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Molecular Weight: 432.54
Empirical Formula: C21H28N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.958
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 90
Number of rings: 4

     

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