COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042926
Chemical Name: 4-[(1E)-1-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]-2-methoxyphenolate
Smiles: COc1cccc(c1)c1c(nnn1c1nonc1[NH3+])C(=O)N/N=C(/c1ccc(c(c1)OC)[O-])\C

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Molecular Weight: 464.44
Empirical Formula: C21H20N8O5

Physical State: Dry powder
Available Amount: 260 mg

Lipinsky:
logP: 0.636
Rotatable bonds: 6
H-donors: 4
H-acceptors: 5
PSA: 180
Number of rings: 4

     

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