COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054949
Chemical Name: 2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(2-nitrobenzylidene)hydrazinyl]carbonyl}-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Smiles: Nc1nonc1n1nnc(c1CNc1ccccc1C(=O)N)C(=O)N/N=C/c1ccccc1[N+](=O)[O-]

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Molecular Weight: 491.43
Empirical Formula: C20H17N11O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.219
Rotatable bonds: 6
H-donors: 6
H-acceptors: 5
PSA: 238
Number of rings: 4

     

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