COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK573028
Chemical Name: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(2-fluorophenyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: Cc1nnc(s1)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccccc1F

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Molecular Weight: 453.45
Empirical Formula: C22H16FN3O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.384
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 130
Number of rings: 5

     

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