COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052041
Chemical Name: 2-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)ammonio]methyl}-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoate
Smiles: C[NH+](C1CCCCC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1C(=O)[O-]

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Molecular Weight: 467.49
Empirical Formula: C21H25N9O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.349
Rotatable bonds: 6
H-donors: 4
H-acceptors: 4
PSA: 181
Number of rings: 4

     

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