COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL147952
Chemical Name: N-[(2E)-6-bromo-1,3-benzothiazol-2(3H)-ylidene]-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Smiles: Brc1ccc2c(c1)s/c(=N/C(=O)C13CCC(C3(C)C)(C(=O)O1)C)/[nH]2

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Molecular Weight: 409.3
Empirical Formula: C17H17BrN2O3S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 3.554
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 93
Number of rings: 4

     

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