COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK598531
Chemical Name: (4E)-5-[3-(benzyloxy)phenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-2,3-dione
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1c1nnc(s1)SCc1ccccc1F)c1cccc(c1)OCc1ccccc1

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Molecular Weight: 667.74
Empirical Formula: C35H26FN3O6S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.763
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 164
Number of rings: 7

     

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