COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK142107
Chemical Name: methyl3-{[({4-ethyl-5-[(3-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Smiles: COC(=O)c1cccc(c1)NC(=O)CSc1nnc(n1CC)COc1cccc(c1)C

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Molecular Weight: 440.52
Empirical Formula: C22H24N4O4S

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 4.667
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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