COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK819589
Chemical Name: (5Z)-4-methyl-5-({3-[2-methyl-4-(prop-2-en-1-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2,6-dioxo-1-propyl-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCCN1C(=O)/C(=C\c2cn(nc2c2ccc(cc2C)OCC=C)c2ccccc2)/C(=C(C1=O)C#N)C

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Molecular Weight: 492.58
Empirical Formula: C30H28N4O3

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 6.673
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 88
Number of rings: 4

     

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