COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL173811
Chemical Name: 4-{[(E)-{4-methoxy-3-[(4-methyl-2-nitrophenoxy)methyl]phenyl}methylidene]amino}-5-methyl-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1COc1ccc(cc1[N+](=O)[O-])C)/C=N/n1c(C)nnc1S

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Molecular Weight: 413.46
Empirical Formula: C19H19N5O4S

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 4.394
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 146
Number of rings: 3

     

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