COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL326675
Chemical Name: 4-(4-bromophenyl)-5-cyano-2-oxo-3-(quinolinium-1-yl)-3,4-dihydro-2H-pyran-6-olate
Smiles: N#CC1=C([O-])OC(=O)C(C1c1ccc(cc1)Br)[n+]1cccc2c1cccc2

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Molecular Weight: 421.25
Empirical Formula: C21H13BrN2O3

Available Amount: 0 mg

Lipinsky:
logP: 0
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 77
Number of rings: 4

     

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