COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK540694
Chemical Name: 6-tert-butyl-2-[(3-methoxybenzyl)sulfanyl]-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: COc1ccc(cc1)c1c(C#N)c(SCc2cccc(c2)OC)nc2c1CC(CC2)C(C)(C)C

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Molecular Weight: 472.65
Empirical Formula: C29H32N2O2S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 7.601
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 80
Number of rings: 4

     

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