COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL484752
Chemical Name: (5Z)-5-[3,5-dichloro-4-(prop-2-yn-1-yloxy)benzylidene]-1-(3-nitrophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: C#CCOc1c(Cl)cc(cc1Cl)/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 460.23
Empirical Formula: C20H11Cl2N3O6

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 3.488
Rotatable bonds: 1
H-donors: 1
H-acceptors: 6
PSA: 121
Number of rings: 3

     

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