COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL442870
Chemical Name: (4Z)-1-(4-methylphenyl)-4-{[5-(4-nitrophenyl)furan-2-yl]methylidene}pyrazolidine-3,5-dione
Smiles: Cc1ccc(cc1)N1NC(=O)/C(=C/c2ccc(o2)c2ccc(cc2)[N+](=O)[O-])/C1=O

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Molecular Weight: 389.37
Empirical Formula: C21H15N3O5

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 4.659
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 108
Number of rings: 4

     

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