COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL375080
Chemical Name: 4-({2-bromo-4-[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-6-methoxyphenoxy}methyl)benzoicacid
Smiles: COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(c1OCc1ccc(cc1)C(=O)O)Br

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Molecular Weight: 491.32
Empirical Formula: C20H15BrN2O6S

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 3.653
Rotatable bonds: 5
H-donors: 3
H-acceptors: 6
PSA: 146
Number of rings: 3

     

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