COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL236878
Chemical Name: N-(butan-2-yl)-2-{4-[4-cyano-1-(2-methylpropyl)-5,6,7,8-tetrahydroisoquinolin-3-yl]piperazin-1-yl}-2-oxoacetamide
Smiles: CCC(NC(=O)C(=O)N1CCN(CC1)c1nc(CC(C)C)c2c(c1C#N)CCCC2)C

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Molecular Weight: 425.57
Empirical Formula: C24H35N5O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.462
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 89
Number of rings: 3

     

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