COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048490
Chemical Name: (5E)-2-(4-acetylpiperazin-1-yl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-1,3-thiazol-4(5H)-one
Smiles: CC(=O)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(o2)c2ccccc2[N+](=O)[O-])/S1

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Molecular Weight: 426.45
Empirical Formula: C20H18N4O5S

Physical State: Dry powder
Available Amount: 295 mg

Lipinsky:
logP: 2.202
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 137
Number of rings: 4

     

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