COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK525230
Chemical Name: 6-tert-butyl-2-[(3-methoxybenzyl)sulfanyl]-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: COc1cccc(c1)CSc1nc2CCC(Cc2c(c1C#N)c1cccs1)C(C)(C)C

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Molecular Weight: 448.65
Empirical Formula: C26H28N2OS2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.591
Rotatable bonds: 5
H-donors: 0
H-acceptors: 1
PSA: 99
Number of rings: 4

     

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