COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL491736
Chemical Name: 4-{[4-(pyridin-3-ylmethyl)piperazin-1-ium-1-yl]methyl}-3-(thiophen-3-ylcarbonyl)-1-benzofuran-5-olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCN(CC1)Cc1cccnc1)c(co2)C(=O)c1cscc1

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Molecular Weight: 433.53
Empirical Formula: C24H23N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.316
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 102
Number of rings: 5

     

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