COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK559015
Chemical Name: (4E)-2-(4-fluorophenyl)-5-hydroxy-4-{[5-(1-oxo-1,3-dihydro-2-benzofuran-5-yl)furan-2-yl]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Smiles: Fc1ccc(cc1)N1N=C(/C(=C\c2ccc(o2)c2ccc3c(c2)COC3=O)/C1=O)O

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Molecular Weight: 404.35
Empirical Formula: C22H13FN2O5

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 3.416
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 92
Number of rings: 5

     

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