COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK613085
Chemical Name: (4E)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-(3-methoxypropyl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: COCCCN1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccc(cc2)OCc2cccc(c2)C)\O)/C(=O)C1=O

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Molecular Weight: 516.55
Empirical Formula: C29H28N2O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.074
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 121
Number of rings: 4

     

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