COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK991998
Chemical Name: (2Z)-6-hydroxy-2-[(3-methylthiophen-2-yl)methylidene]-7-(piperidin-1-ylmethyl)-1-benzofuran-3(2H)-one
Smiles: Oc1ccc2c(c1CN1CCCCC1)O/C(=C\c1sccc1C)/C2=O

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Molecular Weight: 355.46
Empirical Formula: C20H21NO3S

Physical State: Dry powder
Available Amount: 84 mg

Lipinsky:
logP: 3.781
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 78
Number of rings: 4

     

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