COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186612
Chemical Name: 3-{[({5-[(2-ethoxy-4-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoicacid
Smiles: CCOc1cc(C)ccc1OCc1nnc(n1c1ccccc1)SCC(=O)Nc1cccc(c1)C(=O)O

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Molecular Weight: 518.59
Empirical Formula: C27H26N4O5S

Physical State: Dry powder
Available Amount: 213 mg

Lipinsky:
logP: 6.537
Rotatable bonds: 10
H-donors: 2
H-acceptors: 5
PSA: 140
Number of rings: 4

     

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