COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL168243
Chemical Name: (2Z,5E)-3-(4-ethylphenyl)-2-[(4-ethylphenyl)imino]-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-1,3-thiazolidin-4-one
Smiles: CCc1ccc(cc1)N1/C(=N/c2ccc(cc2)CC)/S/C(=C/c2cc3OCOc3cc2[N+](=O)[O-])/C1=O

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Molecular Weight: 501.56
Empirical Formula: C27H23N3O5S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 8.259
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 122
Number of rings: 5

     

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