COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK600248
Chemical Name: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(4-ethylphenyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: CCc1ccc(cc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)C

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Molecular Weight: 463.51
Empirical Formula: C24H21N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.324
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 130
Number of rings: 5

     

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