COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK631210
Chemical Name: (4E)-5-(3,4-diethoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[3-(dimethylamino)propyl]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1CCCN(C)C

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Molecular Weight: 510.59
Empirical Formula: C28H34N2O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.983
Rotatable bonds: 10
H-donors: 1
H-acceptors: 7
PSA: 97
Number of rings: 4

     

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