COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380132
Chemical Name: (4E)-4-(4-hydroxy-3-methoxybenzylidene)-2-(4-iodophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc(ccc1O)/C=C/1\C(=NN(C1=O)c1ccc(cc1)I)C

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Molecular Weight: 434.23
Empirical Formula: C18H15IN2O3

Physical State: Dry powder
Available Amount: 10 mg

Lipinsky:
logP: 3.573
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 3

     

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