COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL264744
Chemical Name: (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-2-{[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5-dihydro-4H-imidazol-4-one
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])CSC1=N/C(=C/c2ccc3c(c2)OCO3)/C(=O)N1c1ccccc1

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Molecular Weight: 487.49
Empirical Formula: C25H17N3O6S

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 5.77
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 139
Number of rings: 5

     

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