COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK612709
Chemical Name: 1-(2-methylpropyl)-3-[4-(phenylcarbonyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(nc(c2c1CCCC2)CC(C)C)N1CCN(CC1)C(=O)c1ccccc1

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Molecular Weight: 402.54
Empirical Formula: C25H30N4O

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.052
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 60
Number of rings: 4

     

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