COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK588727
Chemical Name: (5E)-5-{[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-1,4-dimethyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(C)/C(=C\c2cn(nc2c2cc3c(o2)cccc3)c2ccccc2)/C(=O)N(C1=O)C

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Molecular Weight: 434.45
Empirical Formula: C26H18N4O3

Physical State: Dry powder
Available Amount: 401 mg

Lipinsky:
logP: 5.131
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 92
Number of rings: 5

     

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