COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK725076
Chemical Name: 1-(4-bromophenyl)-2-[4-hydroxy-1,1-dioxido-3-(phenylcarbonyl)-2H-1,2-benzothiazin-2-yl]ethanone
Smiles: Brc1ccc(cc1)C(=O)CN1C(=C(O)c2c(S1(=O)=O)cccc2)C(=O)c1ccccc1

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Molecular Weight: 498.35
Empirical Formula: C23H16BrNO5S

Physical State: Dry powder
Available Amount: 348 mg

Lipinsky:
logP: 6.056
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 100
Number of rings: 4

     

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