COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK003474
Chemical Name: 3-(butylamino)-2-(2,3-dimethylcyclohexyl)-2,3-dihydro-1H-isoindol-1-one
Smiles: CCCCNC1c2ccccc2C(=O)N1C1CCCC(C1C)C

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Saltdata: HCl
Molecular Weight: 314.47
Empirical Formula: C20H30N2O

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 3.996
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 32
Number of rings: 3

     

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