COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK820373
Chemical Name: (5Z)-5-{[5-(2-chlorophenyl)furan-2-yl]methylidene}-1-(3-hydroxypropyl)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: OCCCN1C(=O)/C(=C\c2ccc(o2)c2ccccc2Cl)/C(=C(C1=O)C#N)C

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Molecular Weight: 396.83
Empirical Formula: C21H17ClN2O4

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 3.739
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 94
Number of rings: 3

     

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