COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK733021
Chemical Name: ethyl4-{[3-(phenoxymethyl)-4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]methyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)Cn1nc(n(c1=S)c1ccccc1)COc1ccccc1

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Molecular Weight: 453.57
Empirical Formula: C23H27N5O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.215
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 92
Number of rings: 4

     

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