COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK175309
Chemical Name: (4-{(E)-[1-(1,3-benzodioxol-5-yl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-chloro-6-methoxyphenoxy)aceticacid
Smiles: COc1cc(/C=C/2\C(=O)NC(=O)N(C2=O)c2ccc3c(c2)OCO3)cc(c1OCC(=O)O)Cl

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Molecular Weight: 474.81
Empirical Formula: C21H15ClN2O9

Physical State: Dry powder
Available Amount: 477 mg

Lipinsky:
logP: 2.336
Rotatable bonds: 6
H-donors: 2
H-acceptors: 9
PSA: 140
Number of rings: 4

     

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