COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK030390
Chemical Name: 3-[(2-chloro-4-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-6-methoxyphenoxy)methyl]benzoicacid
Smiles: C=CCN1C(=S)NC(=O)/C(=C\c2cc(Cl)c(c(c2)OC)OCc2cccc(c2)C(=O)O)/C1=O

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Molecular Weight: 486.93
Empirical Formula: C23H19ClN2O6S

Physical State: Dry powder
Available Amount: 29 mg

Lipinsky:
logP: 4.316
Rotatable bonds: 9
H-donors: 2
H-acceptors: 6
PSA: 137
Number of rings: 3

     

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