COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK604809
Chemical Name: 1-butyl-3-{[2-(dimethylamino)ethyl]amino}-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: CCCCc1nc(NCCN(C)C)c(c2c1CCCC2)C#N

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Molecular Weight: 300.45
Empirical Formula: C18H28N4

Physical State: Dry powder
Available Amount: 338 mg

Lipinsky:
logP: 4.772
Rotatable bonds: 5
H-donors: 1
H-acceptors: 0
PSA: 51
Number of rings: 2

     

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