COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL264692
Chemical Name: 2-{[(2-oxoazepan-1-yl)methyl]sulfanyl}-3-(2-oxo-2-phenylethyl)-1,3-benzothiazol-3-ium
Smiles: O=C1CCCCCN1CSc1sc2c([n+]1CC(=O)c1ccccc1)cccc2

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Saltdata: Br-
Molecular Weight: 411.57
Empirical Formula: C22H23N2O2S2

Available Amount: 0 mg

Lipinsky:
logP: 0
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 94
Number of rings: 4

     

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