COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK097401
Chemical Name: (5Z)-5-{3-methoxy-4-[(2-nitrobenzyl)oxy]benzylidene}-1-(prop-2-en-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: C=CCN1C(=O)NC(=O)/C(=C/c2ccc(c(c2)OC)OCc2ccccc2[N+](=O)[O-])/C1=O

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Molecular Weight: 437.41
Empirical Formula: C22H19N3O7

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 2.979
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 130
Number of rings: 3

     

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