COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL439635
Chemical Name: 4-(ethoxycarbonyl)-3-(2-oxo-2-phenylethyl)-1-{[(E)-phenylmethylidene]amino}-1H-1,2,3-triazol-3-ium-5-olate
Smiles: CCOC(=O)c1[n+](CC(=O)c2ccccc2)nn(c1[O-])/N=C/c1ccccc1

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Molecular Weight: 378.39
Empirical Formula: C20H18N4O4

Physical State: Dry powder
Available Amount: 545 mg

Lipinsky:
logP: 0
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 3

     

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