COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK991741
Chemical Name: (5Z)-5-{[(3,5-dimethylphenyl)amino]methylidene}-1-(1,1-dioxidotetrahydrothiophen-3-yl)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(C)/C(=C/Nc2cc(C)cc(c2)C)/C(=O)N(C1=O)C1CCS(=O)(=O)C1

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Molecular Weight: 399.47
Empirical Formula: C20H21N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.788
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 115
Number of rings: 3

     

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