COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK552225
Chemical Name: 4-(3,5-dibromo-4-hydroxyphenyl)-2-(methylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(SC)NC(=O)CC1c1cc(Br)c(c(c1)Br)O

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Molecular Weight: 418.11
Empirical Formula: C13H10Br2N2O2S

Physical State: Dry powder
Available Amount: 355 mg

Lipinsky:
logP: 3.658
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 98
Number of rings: 2

     

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