COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK187928
Chemical Name: (5Z)-5-[3-bromo-4-(prop-2-yn-1-yloxy)benzylidene]-1-(4-ethoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: C#CCOc1ccc(cc1Br)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccc(cc1)OCC

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Molecular Weight: 485.36
Empirical Formula: C22H17BrN2O4S

Physical State: Dry powder
Available Amount: 134 mg

Lipinsky:
logP: 4.318
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 3

     

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