COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK860532
Chemical Name: 2-(benzylsulfanyl)-4-(4-hydroxy-3-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(SCc2ccccc2)NC(=O)CC1c1ccc(c(c1)OC)O

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Molecular Weight: 366.44
Empirical Formula: C20H18N2O3S

Physical State: Dry powder
Available Amount: 265 mg

Lipinsky:
logP: 3.358
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 107
Number of rings: 3

     

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