COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK134021
Chemical Name: 3-benzyl-2-[2-(3,4-dimethoxyphenyl)ethyl]-3-hydroxy-2,3-dihydro-1H-isoindol-1-one
Smiles: COc1cc(ccc1OC)CCN1C(=O)c2c(C1(O)Cc1ccccc1)cccc2

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Molecular Weight: 403.48
Empirical Formula: C25H25NO4

Physical State: Dry powder
Available Amount: 38 mg

Lipinsky:
logP: 3.293
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 59
Number of rings: 4

     

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