COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL505011
Chemical Name: 5-[3-iodo-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: C#CCOc1c(I)cc(cc1OC)C=C1C(=O)NC(=S)NC1=O

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Molecular Weight: 442.23
Empirical Formula: C15H11IN2O4S

Physical State: Dry powder
Available Amount: 528 mg

Lipinsky:
logP: 2.531
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 108
Number of rings: 2

     

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