COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK251443
Chemical Name: 4-ethyl-3-[(4-nitrobenzyl)sulfanyl]-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-4H-1,2,4-triazole
Smiles: CCn1c(COc2ccc3c(c2)CCCC3)nnc1SCc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 424.52
Empirical Formula: C22H24N4O3S

Physical State: Dry powder
Available Amount: 131 mg

Lipinsky:
logP: 6.016
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 111
Number of rings: 4

     

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