COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL172216
Chemical Name: (2-ethoxy-4-{(E)-[1-(4-iodophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetonitrile
Smiles: CCOc1cc(ccc1OCC#N)/C=C/1\C(=NN(C1=O)c1ccc(cc1)I)C

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Molecular Weight: 487.3
Empirical Formula: C21H18IN3O3

Physical State: Dry powder
Available Amount: 20 mg

Lipinsky:
logP: 4.392
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 74
Number of rings: 3

     

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