COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042114
Chemical Name: (4E)-1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-[hydroxy(phenyl)methylidene]-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1cccnc1)c1nnc(s1)SCc1ccccc1)/c1ccccc1

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Molecular Weight: 486.58
Empirical Formula: C25H18N4O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.893
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 149
Number of rings: 5

     

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