COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK748822
Chemical Name: ethyl4-{[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-3-oxobutanoate
Smiles: CCOC(=O)CC(=O)CSc1nc2CCCCc2c(c1C#N)c1cccs1

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Molecular Weight: 400.52
Empirical Formula: C20H20N2O3S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.402
Rotatable bonds: 8
H-donors: 0
H-acceptors: 3
PSA: 133
Number of rings: 3

     

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