COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK664500
Chemical Name: ethyl1-[(4-ethyl-3-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)methyl]piperidine-4-carboxylate
Smiles: CCn1c(nn(c1=S)CN1CCC(CC1)C(=O)OCC)c1ccccc1

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Molecular Weight: 374.51
Empirical Formula: C19H26N4O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.92
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 80
Number of rings: 3

     

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