COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK036953
Chemical Name: 3-[(2,3-dimethylcyclohexyl)amino]-2-(3-methylbutyl)-2,3-dihydro-1H-isoindol-1-one
Smiles: CC(CCN1C(=O)c2c(C1NC1CCCC(C1C)C)cccc2)C

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Molecular Weight: 328.5
Empirical Formula: C21H32N2O

Physical State: Liquid
Available Amount: 83 mg

Lipinsky:
logP: 4.343
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 32
Number of rings: 3

     

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