COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK066078
Chemical Name: (5E)-5-[3-bromo-4-(prop-2-en-1-yloxy)benzylidene]-1-(3-ethoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: C=CCOc1ccc(cc1Br)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1)OCC

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Molecular Weight: 487.37
Empirical Formula: C22H19BrN2O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.086
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 3

     

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