COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK106899
Chemical Name: (4Z)-1-(3-fluorophenyl)-4-{[5-(2-nitrophenyl)furan-2-yl]methylidene}pyrazolidine-3,5-dione
Smiles: Fc1cccc(c1)N1NC(=O)/C(=C/c2ccc(o2)c2ccccc2[N+](=O)[O-])/C1=O

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Molecular Weight: 393.33
Empirical Formula: C20H12FN3O5

Physical State: Dry powder
Available Amount: 298 mg

Lipinsky:
logP: 4.182
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 108
Number of rings: 4

     

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