COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK830172
Chemical Name: 1-ethyl-3-oxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Smiles: CCc1[nH]c(=O)c(c2c1CCCC2)C#N

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Molecular Weight: 202.26
Empirical Formula: C12H14N2O

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 1.851
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 52
Number of rings: 2

     

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