COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK604871
Chemical Name: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[3-(dimethylamino)propyl]-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1c(OC)cc(cc1OC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1CCCN(C)C

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Molecular Weight: 512.56
Empirical Formula: C27H32N2O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.622
Rotatable bonds: 7
H-donors: 1
H-acceptors: 8
PSA: 107
Number of rings: 4

     

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