COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL412327
Chemical Name: (4E)-5-hydroxy-4-(3-iodobenzylidene)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Ic1cccc(c1)/C=C/1\C(=NN(C1=O)c1ccccc1)O

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Molecular Weight: 390.18
Empirical Formula: C16H11IN2O2

Physical State: Dry powder
Available Amount: 161 mg

Lipinsky:
logP: 4.216
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 3

     

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