COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK613292
Chemical Name: (4E)-1-[2-(dimethylamino)ethyl]-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-(3-hydroxyphenyl)pyrrolidine-2,3-dione
Smiles: CN(CCN1C(c2cccc(c2)O)/C(=C(/c2ccc(cc2)OCc2cccc(c2)C)\O)/C(=O)C1=O)C

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Molecular Weight: 486.57
Empirical Formula: C29H30N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.628
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 90
Number of rings: 4

     

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