COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK508934
Chemical Name: 4,4'-[(1E)-1-(5-nitrofuran-2-yl)prop-1-ene-3,3-diyl]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Smiles: [O-][N+](=O)c1ccc(o1)/C=C/C(c1c(C)n(n(c1=O)c1ccccc1)C)c1c(C)n(n(c1=O)c1ccccc1)C

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Molecular Weight: 525.56
Empirical Formula: C29H27N5O5

Physical State: Dry powder
Available Amount: 152 mg

Lipinsky:
logP: 2.341
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 106
Number of rings: 5

     

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