COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK021703
Chemical Name: N-[(E)-(3-nitrophenyl)methylidene]-4H-1,2,4-triazol-4-amine
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/n1cnnc1

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Molecular Weight: 217.19
Empirical Formula: C9H7N5O2

Physical State: Dry powder
Available Amount: 398 mg

Lipinsky:
logP: 1.137
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 88
Number of rings: 2

     

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