COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK514681
Chemical Name: (5E)-5-{[3-(2,7-dimethyl-2,3-dihydro-1-benzofuran-5-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-1-(3-hydroxypropyl)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: OCCCN1C(=O)/C(=C/c2cn(nc2c2cc(C)c3c(c2)CC(O3)C)c2ccccc2)/C(=C(C1=O)C#N)C

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Molecular Weight: 508.58
Empirical Formula: C30H28N4O4

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 4.68
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 108
Number of rings: 5

     

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