COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK587551
Chemical Name: (5Z)-5-{4-[(2-chlorobenzyl)oxy]benzylidene}-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/c2ccc(cc2)OCc2ccccc2Cl)/C(=O)N(C1=O)C1CCS(=O)(=O)C1

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Molecular Weight: 496.97
Empirical Formula: C25H21ClN2O5S

Physical State: Dry powder
Available Amount: 405 mg

Lipinsky:
logP: 3.164
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 112
Number of rings: 4

     

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