COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050926
Chemical Name: 2-[(1E)-1-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-propoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]benzoate
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1[NH3+])C(=O)N/N=C(/c1ccccc1C(=O)[O-])\C

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Molecular Weight: 490.48
Empirical Formula: C23H22N8O5

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 1.285
Rotatable bonds: 5
H-donors: 4
H-acceptors: 5
PSA: 188
Number of rings: 4

     

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