COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK400877
Chemical Name: 2-({4-ethyl-5-[(4-methoxyphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-nitrophenyl)acetamide
Smiles: COc1ccc(cc1)OCc1nnc(n1CC)SCC(=O)Nc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 443.48
Empirical Formula: C20H21N5O5S

Physical State: Dry powder
Available Amount: 605 mg

Lipinsky:
logP: 4.182
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 149
Number of rings: 3

     

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