COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK377020
Chemical Name: (2Z)-2-[3-nitro-4-(piperidin-1-yl)benzylidene]-1-benzothiophen-3(2H)-one
Smiles: [O-][N+](=O)c1cc(ccc1N1CCCCC1)/C=C/1\Sc2c(C1=O)cccc2

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Molecular Weight: 366.44
Empirical Formula: C20H18N2O3S

Physical State: Dry powder
Available Amount: 86 mg

Lipinsky:
logP: 5.965
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 91
Number of rings: 4

     

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