COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK639000
Chemical Name: 3-{[3-(4-methoxybenzyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]methyl}benzoicacid
Smiles: COc1ccc(cc1)Cc1n[nH]c(=S)n1Cc1cccc(c1)C(=O)O

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Molecular Weight: 355.42
Empirical Formula: C18H17N3O3S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 2.331
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 106
Number of rings: 3

     

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