COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL320136
Chemical Name: 2-({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}methyl)-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Smiles: O=c1cc2CCCCCc2nn1CN1CCN(CC1)C/C=C/c1ccccc1

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Molecular Weight: 378.52
Empirical Formula: C23H30N4O

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 2.465
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 39
Number of rings: 4

     

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