COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK864213
Chemical Name: 2-({3-[(4-tert-butylphenyl)sulfonyl]-2-hydroxypropyl}sulfanyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#Cc1cc2CCCCc2nc1SCC(CS(=O)(=O)c1ccc(cc1)C(C)(C)C)O

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Molecular Weight: 444.62
Empirical Formula: C23H28N2O3S2

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 5.384
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 124
Number of rings: 3

     

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