COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK777035
Chemical Name: (2E)-6-ethoxy-2-(1-ethyl-6-methylquinolin-2(1H)-ylidene)-1-benzothiophen-3(2H)-one
Smiles: CCOc1ccc2c(c1)S/C(=c/1\ccc3c(n1CC)ccc(c3)C)/C2=O

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Molecular Weight: 363.48
Empirical Formula: C22H21NO2S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 4.426
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 54
Number of rings: 4

     

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