COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL009467
Chemical Name: (5Z)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-{[(4-hydroxy-2-methylphenyl)amino]methylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(C)/C(=C/Nc2ccc(cc2C)O)/C(=O)N(C1=O)C1CCS(=O)(=O)C1

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Molecular Weight: 401.44
Empirical Formula: C19H19N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.416
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 135
Number of rings: 3

     

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