COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK059763
Chemical Name: (5Z)-5-[4-(benzyloxy)-5-methoxy-2-nitrobenzylidene]-1-(3-bromophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2cccc(c2)Br)c(cc1OCc1ccccc1)[N+](=O)[O-]

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Molecular Weight: 552.34
Empirical Formula: C25H18BrN3O7

Physical State: Dry powder
Available Amount: 139 mg

Lipinsky:
logP: 4.927
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 130
Number of rings: 4

     

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