COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK086449
Chemical Name: (5E)-1-(4-chlorophenyl)-5-{3-[2-(4-nitrophenoxy)ethoxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2cccc(c2)OCCOc2ccc(cc2)[N+](=O)[O-])/C1=O

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Molecular Weight: 507.89
Empirical Formula: C25H18ClN3O7

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 4.796
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 130
Number of rings: 4

     

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