COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK563315
Chemical Name: (Z)-[1-(5-bromopyridinium-2-yl)-2-(2-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene](4-nitrophenyl)methanolate
Smiles: Brc1ccc([nH+]c1)N1C(=O)C(=O)/C(=C(/c2ccc(cc2)[N+](=O)[O-])\[O-])/C1c1ccccc1F

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Molecular Weight: 498.26
Empirical Formula: C22H13BrFN3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.172
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 120
Number of rings: 4

     

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