COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL438261
Chemical Name: ethyl5-[2-(4-bromophenyl)-2-oxoethoxy]-1-{[(E)-(3-fluorophenyl)methylidene]amino}-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1OCC(=O)c1ccc(cc1)Br)/N=C/c1cccc(c1)F

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Molecular Weight: 475.27
Empirical Formula: C20H16BrFN4O4

Physical State: Dry powder
Available Amount: 536 mg

Lipinsky:
logP: 4.152
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 95
Number of rings: 3

     

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