COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL041059
Chemical Name: (5E)-1-(4-bromophenyl)-2-hydroxy-5-{[1-(4-nitrobenzyl)-1H-indol-3-yl]methylidene}pyrimidine-4,6(1H,5H)-dione
Smiles: Brc1ccc(cc1)N1C(=NC(=O)/C(=C\c2cn(c3c2cccc3)Cc2ccc(cc2)[N+](=O)[O-])/C1=O)O

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Molecular Weight: 545.35
Empirical Formula: C26H17BrN4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.193
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 120
Number of rings: 5

     

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