COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK056411
Chemical Name: 3-(benzylsulfanyl)-2-butyl-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one
Smiles: CCCCN1C(SCc2ccccc2)C2=C(C1=O)CCCC2

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Molecular Weight: 315.48
Empirical Formula: C19H25NOS

Physical State: Liquid
Available Amount: 365 mg

Lipinsky:
logP: 4.403
Rotatable bonds: 5
H-donors: 0
H-acceptors: 1
PSA: 45
Number of rings: 3

     

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