COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK514839
Chemical Name: (5Z)-1-ethyl-4-methyl-2,6-dioxo-5-({1-phenyl-3-[4-(propan-2-yloxy)phenyl]-1H-pyrazol-4-yl}methylidene)-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCN1C(=O)/C(=C\c2cn(nc2c2ccc(cc2)OC(C)C)c2ccccc2)/C(=C(C1=O)C#N)C

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Molecular Weight: 466.54
Empirical Formula: C28H26N4O3

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 5.755
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 88
Number of rings: 4

     

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