COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK568408
Chemical Name: 4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2,6-dimethoxyphenolate
Smiles: COc1cccc(c1)c1c(nnn1c1nonc1[NH3+])C(=O)N/N=C/c1cc(OC)c(c(c1)OC)[O-]

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Molecular Weight: 480.44
Empirical Formula: C21H20N8O6

Physical State: Dry powder
Available Amount: 255 mg

Lipinsky:
logP: -0.364
Rotatable bonds: 6
H-donors: 4
H-acceptors: 6
PSA: 189
Number of rings: 4

     

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