COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052943
Chemical Name: (4E)-5-(2,4-dimethoxyphenyl)-1-hexadecyl-4-[hydroxy(4-nitrophenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CCCCCCCCCCCCCCCCN1C(c2ccc(cc2OC)OC)/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C1=O

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Molecular Weight: 608.78
Empirical Formula: C35H48N2O7

Physical State: Dry powder
Available Amount: 260 mg

Lipinsky:
logP: 10.517
Rotatable bonds: 19
H-donors: 1
H-acceptors: 7
PSA: 121
Number of rings: 3

     

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