COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050083
Chemical Name: 2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(2-chlorophenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-4-bromophenolate
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1c1ccccc1Cl)c1nonc1[NH3+])[O-]

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Molecular Weight: 503.7
Empirical Formula: C18H12BrClN8O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.546
Rotatable bonds: 4
H-donors: 4
H-acceptors: 3
PSA: 161
Number of rings: 4

     

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