COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK067918
Chemical Name: 3-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-1-(thiophen-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCC(=O)N2CCCCC2)nc(c2c1CCCC2)c1cccs1

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Molecular Weight: 397.57
Empirical Formula: C21H23N3OS2

Physical State: Dry powder
Available Amount: 446 mg

Lipinsky:
logP: 5.179
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 110
Number of rings: 4

     

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