COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK201645
Chemical Name: 4-[(4-{(E)-[1-(1,3-benzodioxol-5-yl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-5-bromo-2-methoxyphenoxy)methyl]benzoicacid
Smiles: COc1cc(/C=C/2\C(=O)NC(=O)N(C2=O)c2ccc3c(c2)OCO3)c(cc1OCc1ccc(cc1)C(=O)O)Br

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Molecular Weight: 595.36
Empirical Formula: C27H19BrN2O9

Physical State: Dry powder
Available Amount: 141 mg

Lipinsky:
logP: 4.825
Rotatable bonds: 5
H-donors: 2
H-acceptors: 9
PSA: 140
Number of rings: 5

     

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