COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK908619
Chemical Name: (5Z)-5-[4-(dimethylamino)benzylidene]-4-methyl-2,6-dioxo-1-pentyl-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCCCCN1C(=O)/C(=C\c2ccc(cc2)N(C)C)/C(=C(C1=O)C#N)C

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Saltdata: HCl
Molecular Weight: 351.45
Empirical Formula: C21H25N3O2

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 5.106
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 64
Number of rings: 2

     

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