COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL033326
Chemical Name: (2Z)-6-hydroxy-7-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2-[(3-methylthiophen-2-yl)methylidene]-1-benzofuran-3(2H)-one
Smiles: OCCN1CCN(CC1)Cc1c(O)ccc2c1O/C(=C\c1sccc1C)/C2=O

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O S N N O HO HO
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Molecular Weight: 400.5
Empirical Formula: C21H24N2O4S

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 1.681
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 101
Number of rings: 4

     

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