COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK053240
Chemical Name: 2-[(4-cyano-1-ethyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(4-hydroxyphenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)O)nc(c2c1CCCC2)CC

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Molecular Weight: 367.47
Empirical Formula: C20H21N3O2S

Physical State: Dry powder
Available Amount: 349 mg

Lipinsky:
logP: 4.188
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 111
Number of rings: 3

     

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