COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK245454
Chemical Name: 3-[({[4-ethyl-5-(4-methoxybenzyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: COc1ccc(cc1)Cc1nnc(n1CC)SCC(=O)Nc1cccc(c1)C(=O)O

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Molecular Weight: 426.5
Empirical Formula: C21H22N4O4S

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 4.14
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 131
Number of rings: 3

     

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