COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK377036
Chemical Name: (4-{(E)-[1-(3-chloro-4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}-2-methoxyphenoxy)aceticacid
Smiles: COc1cc(ccc1OCC(=O)O)/C=C/1\C(=O)NN(C1=O)c1ccc(c(c1)Cl)C

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Molecular Weight: 416.82
Empirical Formula: C20H17ClN2O6

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 3.263
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 105
Number of rings: 3

     

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