COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545063
Chemical Name: methyl4-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN(C)C)c1nonc1N

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Molecular Weight: 413.4
Empirical Formula: C17H19N9O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.429
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 166
Number of rings: 3

     

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