COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK246100
Chemical Name: N-(3-methoxyphenyl)-2-{4-methyl-5-[(2-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}acetamide
Smiles: COc1cccc(c1)NC(=O)Cc1nnc(n1C)SCc1ccccc1[N+](=O)[O-]

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Molecular Weight: 413.46
Empirical Formula: C19H19N5O4S

Physical State: Dry powder
Available Amount: 97 mg

Lipinsky:
logP: 3.356
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 140
Number of rings: 3

     

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