COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL315805
Chemical Name: 2-{[4-(3-chlorobenzyl)piperazin-1-yl]methyl}-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Smiles: Clc1cccc(c1)CN1CCN(CC1)Cn1nc2CCCCCc2cc1=O

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Molecular Weight: 386.92
Empirical Formula: C21H27ClN4O

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 2.365
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 39
Number of rings: 4

     

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