COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK095816
Chemical Name: (4E)-4-(4-ethoxy-3-iodobenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCOc1ccc(cc1I)/C=C/1\C(=NN(C1=O)c1ccccc1)C

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Molecular Weight: 432.26
Empirical Formula: C19H17IN2O2

Physical State: Dry powder
Available Amount: 280 mg

Lipinsky:
logP: 4.934
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 41
Number of rings: 3

     

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