COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562003
Chemical Name: (4E)-4-[(4-butoxy-3-methylphenyl)(hydroxy)methylidene]-5-(4-hydroxy-3-methoxyphenyl)-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Smiles: CCCCOc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)OC)O)CCCOC)/O

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Molecular Weight: 483.56
Empirical Formula: C27H33NO7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.251
Rotatable bonds: 13
H-donors: 2
H-acceptors: 7
PSA: 105
Number of rings: 3

     

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