COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK508933
Chemical Name: 4,4'-[(2-hydroxy-5-iodophenyl)methanediyl]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Smiles: Ic1ccc(c(c1)C(c1c(C)n(n(c1=O)c1ccccc1)C)c1c(C)n(n(c1=O)c1ccccc1)C)O

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Molecular Weight: 606.46
Empirical Formula: C29H27IN4O3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.41
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 67
Number of rings: 5

     

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