COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK055638
Chemical Name: 2-[(4-cyano-1-ethyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(4-ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nc(CC)c2c(c1C#N)CCCC2

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Molecular Weight: 395.53
Empirical Formula: C22H25N3O2S

Physical State: Dry powder
Available Amount: 342 mg

Lipinsky:
logP: 5.475
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 100
Number of rings: 3

     

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