COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL324595
Chemical Name: 5-(benzylsulfanyl)-2-(bromomethyl)-2,3,8,9,10,11-hexahydro[1]benzothieno[3,2-e][1,3]oxazolo[3,2-c]pyrimidin-4-ium
Smiles: BrCC1C[n+]2c(O1)c1c(nc2SCc2ccccc2)sc2c1CCCC2

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Saltdata: Br-
Molecular Weight: 448.43
Empirical Formula: C20H20BrN2OS2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 79
Number of rings: 5

     

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