COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK940039
Chemical Name: 2-[4-(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazin-1-yl]-N-(3-methoxypropyl)-2-oxoacetamide
Smiles: COCCCNC(=O)C(=O)N1CCN(CC1)c1nc(C)c2c(c1C#N)CCCC2

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Molecular Weight: 399.49
Empirical Formula: C21H29N5O3

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 0.869
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 98
Number of rings: 3

     

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