COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK020760
Chemical Name: N-[(E)-{3-methoxy-4-[2-(4-nitrophenoxy)ethoxy]phenyl}methylidene]-4H-1,2,4-triazol-4-amine
Smiles: COc1cc(ccc1OCCOc1ccc(cc1)[N+](=O)[O-])/C=N/n1cnnc1

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Molecular Weight: 383.36
Empirical Formula: C18H17N5O5

Physical State: Dry powder
Available Amount: 453 mg

Lipinsky:
logP: 2.916
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 116
Number of rings: 3

     

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