COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK633973
Chemical Name: methyl1-{[4-(1,1-dioxido-1,2-thiazinan-2-yl)-2,6-dimethylphenyl]sulfonyl}piperidine-4-carboxylate
Smiles: COC(=O)C1CCN(CC1)S(=O)(=O)c1c(C)cc(cc1C)N1CCCCS1(=O)=O

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Molecular Weight: 444.57
Empirical Formula: C19H28N2O6S2

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 2.124
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 117
Number of rings: 3

     

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