COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL272579
Chemical Name: ethyl4-({[4-benzyl-3-(phenoxymethyl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]acetyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)Cn1nc(n(c1=S)Cc1ccccc1)COc1ccccc1

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Molecular Weight: 502.59
Empirical Formula: C27H26N4O4S

Available Amount: 0 mg

Lipinsky:
logP: 4.259
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 115
Number of rings: 4

     

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