COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150986
Chemical Name: (E)-[2-(4-bromophenyl)-4,5-dioxo-1-(pyridinium-3-yl)pyrrolidin-3-ylidene](phenyl)methanolate
Smiles: Brc1ccc(cc1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1c1ccc[nH+]c1

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Molecular Weight: 435.28
Empirical Formula: C22H15BrN2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.088
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 74
Number of rings: 4

     

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