COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK139110
Chemical Name: (5E)-1-(3-hydroxypropyl)-4-methyl-2,6-dioxo-5-{[5-(1-oxo-1,3-dihydro-2-benzofuran-5-yl)furan-2-yl]methylidene}-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: OCCCN1C(=O)/C(=C/c2ccc(o2)c2ccc3c(c2)COC3=O)/C(=C(C1=O)C#N)C

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Molecular Weight: 418.41
Empirical Formula: C23H18N2O6

Available Amount: 0 mg

Lipinsky:
logP: 2.031
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 120
Number of rings: 4

     

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