COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL170417
Chemical Name: (5Z)-5-(hydroxymethylidene)-1,4-dimethyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: O/C=C\1/C(=C(C#N)C(=O)N(C1=O)C)C

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Molecular Weight: 192.17
Empirical Formula: C9H8N2O3

Physical State: Dry powder
Available Amount: 13 mg

Lipinsky:
logP: 0.038
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 81
Number of rings: 1

     

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