COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK144784
Chemical Name: 2-[(5-{[(4-chlorobenzyl)sulfanyl]methyl}-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide
Smiles: CSc1cccc(c1)NC(=O)CSc1nnc(n1CC)CSCc1ccc(cc1)Cl

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Molecular Weight: 479.09
Empirical Formula: C21H23ClN4OS3

Physical State: Dry powder
Available Amount: 298 mg

Lipinsky:
logP: 6.352
Rotatable bonds: 8
H-donors: 1
H-acceptors: 1
PSA: 135
Number of rings: 3

     

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