COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL162060
Chemical Name: 2-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)Cn1nc2CCCCCc2cc1=O

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Molecular Weight: 400.91
Empirical Formula: C21H25ClN4O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.393
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 56
Number of rings: 4

     

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