COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL445316
Chemical Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[5-(2-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: CCOc1ccccc1c1nnc([nH]1)SCC(=O)Nc1sc2c(c1C#N)CCCC2

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Molecular Weight: 439.56
Empirical Formula: C21H21N5O2S2

Physical State: Dry powder
Available Amount: 197 mg

Lipinsky:
logP: 5.002
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 157
Number of rings: 4

     

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