COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK605180
Chemical Name: 1-ethyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: OCCN1CCN(CC1)c1nc(CC)c2c(c1C#N)CCCC2

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Molecular Weight: 314.43
Empirical Formula: C18H26N4O

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 3.071
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 63
Number of rings: 3

     

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