COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK115600
Chemical Name: 4-[({[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: COc1ccc(cc1)c1nnc(n1CC)SCC(=O)Nc1ccc(cc1)C(=O)O

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Molecular Weight: 412.47
Empirical Formula: C20H20N4O4S

Physical State: Dry powder
Available Amount: 124 mg

Lipinsky:
logP: 4.796
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 131
Number of rings: 3

     

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