COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK696008
Chemical Name: 4,4'-[(3,5-di-tert-butyl-4-hydroxyphenyl)methanediyl]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Smiles: Oc1c(cc(cc1C(C)(C)C)C(c1c(C)n(n(c1=O)c1ccccc1)C)c1c(C)n(n(c1=O)c1ccccc1)C)C(C)(C)C

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Molecular Weight: 592.78
Empirical Formula: C37H44N4O3

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 5.359
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 67
Number of rings: 5

     

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