COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049204
Chemical Name: (4E)-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-(pentyloxy)phenyl]pyrrolidine-2,3-dione
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccccc1F

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Molecular Weight: 645.78
Empirical Formula: C34H32FN3O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.922
Rotatable bonds: 11
H-donors: 1
H-acceptors: 5
PSA: 155
Number of rings: 6

     

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