COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK030403
Chemical Name: 2-[(4-cyano-1-ethyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N,N-diethylacetamide
Smiles: CCN(C(=O)CSc1nc(CC)c2c(c1C#N)CCCC2)CC

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Molecular Weight: 331.48
Empirical Formula: C18H25N3OS

Physical State: Dry powder
Available Amount: 153 mg

Lipinsky:
logP: 4.166
Rotatable bonds: 6
H-donors: 0
H-acceptors: 1
PSA: 82
Number of rings: 2

     

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