COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK626906
Chemical Name: N-(butan-2-yl)-2-[4-(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazin-1-yl]-2-oxoacetamide
Smiles: CCC(NC(=O)C(=O)N1CCN(CC1)c1nc(C)c2c(c1C#N)CCCC2)C

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Molecular Weight: 383.49
Empirical Formula: C21H29N5O2

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 2.052
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 89
Number of rings: 3

     

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