COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK642111
Chemical Name: 1-(4-{[4-(1,1-dioxido-1,2-thiazinan-2-yl)-2,6-dimethylphenyl]sulfonyl}piperazin-1-yl)ethanone
Smiles: CC(=O)N1CCN(CC1)S(=O)(=O)c1c(C)cc(cc1C)N1CCCCS1(=O)=O

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Molecular Weight: 429.56
Empirical Formula: C18H27N3O5S2

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 1.066
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 111
Number of rings: 3

     

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