COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295771
Chemical Name: 3-({(E)-[1-(4-iodophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-4-methylbenzoicacid
Smiles: Ic1ccc(cc1)N1N=C(/C(=C\Nc2cc(ccc2C)C(=O)O)/C1=O)C

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Molecular Weight: 461.26
Empirical Formula: C19H16IN3O3

Physical State: Dry powder
Available Amount: 230 mg

Lipinsky:
logP: 3.731
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 82
Number of rings: 3

     

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