COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380130
Chemical Name: (4E)-4-(3-ethoxy-4-hydroxy-5-iodobenzylidene)-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCOc1cc(/C=C/2\C(=NN(C2=O)c2ccc(cc2)F)C)cc(c1O)I

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Molecular Weight: 466.25
Empirical Formula: C19H16FIN2O3

Physical State: Dry powder
Available Amount: 5 mg

Lipinsky:
logP: 4.074
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 3

     

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