COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056181
Chemical Name: 4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2-methoxyphenolate
Smiles: COc1cc(/C=N/NC(=O)c2nnn(c2C(C)C)c2nonc2[NH3+])ccc1[O-]

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Molecular Weight: 386.37
Empirical Formula: C16H18N8O4

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: -0.004
Rotatable bonds: 5
H-donors: 4
H-acceptors: 4
PSA: 171
Number of rings: 3

     

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