COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL033951
Chemical Name: (2Z)-6-[2-(4-benzylpiperazin-1-yl)ethoxy]-2-(4-methoxybenzylidene)-1-benzofuran-3(2H)-one
Smiles: COc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OCCN1CCN(CC1)Cc1ccccc1

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Saltdata: 2HCl
Molecular Weight: 470.57
Empirical Formula: C29H30N2O4

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 3.994
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 51
Number of rings: 5

     

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