COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK176871
Chemical Name: (5E)-1-(3,5-dimethylphenyl)-5-{3-methoxy-4-[(4-nitrobenzyl)oxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1cc(ccc1OCc1ccc(cc1)[N+](=O)[O-])/C=C/1\C(=O)NC(=O)N(C1=O)c1cc(C)cc(c1)C

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Molecular Weight: 501.5
Empirical Formula: C27H23N3O7

Physical State: Dry powder
Available Amount: 143 mg

Lipinsky:
logP: 4.786
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 130
Number of rings: 4

     

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