COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK597114
Chemical Name: (4E)-4-[hydroxy(thiophen-2-yl)methylidene]-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-phenylpyrrolidine-2,3-dione
Smiles: CSc1nnc(s1)N1C(c2ccccc2)/C(=C(/c2cccs2)\O)/C(=O)C1=O

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Molecular Weight: 415.52
Empirical Formula: C18H13N3O3S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.424
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 165
Number of rings: 4

     

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