COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK098853
Chemical Name: 2-[2-(4-chlorophenyl)ethyl]-3-(2-cyclohexylethoxy)-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one
Smiles: Clc1ccc(cc1)CCN1C(OCCC2CCCCC2)C2=C(C1=O)CCCC2

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Molecular Weight: 401.98
Empirical Formula: C24H32ClNO2

Physical State: Liquid
Available Amount: 92 mg

Lipinsky:
logP: 6.035
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 29
Number of rings: 4

     

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