COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807124
Chemical Name: 2-{[4-methyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone
Smiles: COc1cc(cc(c1OC)OC)c1nnc(n1C)SCC(=O)c1ccccc1

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Molecular Weight: 399.47
Empirical Formula: C20H21N3O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.533
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 3

     

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