COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK860005
Chemical Name: 1,1-dioxido-3-(phenylcarbonyl)-2-(prop-2-en-1-yl)-2H-1,2-benzothiazin-4-yl(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
Smiles: C=CCN1C(=C(OC(=O)CN2C(=O)c3c(C2=O)cccc3)c2c(S1(=O)=O)cccc2)C(=O)c1ccccc1

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Molecular Weight: 528.54
Empirical Formula: C28H20N2O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.101
Rotatable bonds: 6
H-donors: 0
H-acceptors: 7
PSA: 126
Number of rings: 5

     

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