COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK604806
Chemical Name: (4E)-5-(3-ethoxy-4-hydroxyphenyl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(c2ccc(c(c2)OCC)O)/C(=C(/c2ccc(cc2)OCc2cccc(c2)C)\O)/C(=O)C1=O

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Molecular Weight: 531.61
Empirical Formula: C31H33NO7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.844
Rotatable bonds: 11
H-donors: 2
H-acceptors: 7
PSA: 105
Number of rings: 4

     

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