COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051331
Chemical Name: N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-3-bromo-2-oxo-2H-pyran-5-carboxamide
Smiles: O=C(c1coc(=O)c(c1)Br)/N=c\1/sc2c([nH]1)cccc2

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Molecular Weight: 351.18
Empirical Formula: C13H7BrN2O3S

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 2.231
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 93
Number of rings: 3

     

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