COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL443982
Chemical Name: 2-ethyl-1,1-dioxido-3-(phenylcarbonyl)-2H-1,2-benzothiazin-4-yl(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
Smiles: CCN1C(=C(OC(=O)CN2C(=O)c3c(C2=O)cccc3)c2c(S1(=O)=O)cccc2)C(=O)c1ccccc1

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Molecular Weight: 516.53
Empirical Formula: C27H20N2O7S

Physical State: Dry powder
Available Amount: 39 mg

Lipinsky:
logP: 5.869
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 126
Number of rings: 5

     

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