COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK742936
Chemical Name: 2-[(1,1-dioxido-1,2-benzothiazol-3-yl)(methyl)amino]ethyl(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
Smiles: O=C(CN1C(=O)c2c(C1=O)cccc2)OCCN(C1=NS(=O)(=O)c2c1cccc2)C

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Molecular Weight: 427.44
Empirical Formula: C20H17N3O6S

Physical State: Dry powder
Available Amount: 787 mg

Lipinsky:
logP: 2.125
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 113
Number of rings: 4

     

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