COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK528365
Chemical Name: 4,4'-{(2-hydroxy-5-methylbenzene-1,3-diyl)bis[(E)methylylidenenitrilo]}bis(2,5-dimethyl-1-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Smiles: Cc1cc(/C=N/c2c(C)n(n(c2=O)C)c2ccccc2)c(c(c1)/C=N/c1c(C)n(n(c1=O)C)c1ccccc1)O

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Molecular Weight: 534.62
Empirical Formula: C31H30N6O3

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 6.197
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 92
Number of rings: 5

     

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