COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054282
Chemical Name: 4-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(thiophen-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-3-hydroxyphenolate
Smiles: [O-]c1ccc(c(c1)O)/C=N/NC(=O)c1nnn(c1c1cccs1)c1nonc1[NH3+]

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Molecular Weight: 412.39
Empirical Formula: C16H12N8O4S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 1.205
Rotatable bonds: 5
H-donors: 5
H-acceptors: 4
PSA: 210
Number of rings: 4

     

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