COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL147208
Chemical Name: 1-[2-(4-bromophenyl)-2-oxoethyl]-3-(ethoxycarbonyl)-3-hydroxy-1-azoniabicyclo[2.2.2]octane
Smiles: CCOC(=O)C1(O)C[N+]2(CCC1CC2)CC(=O)c1ccc(cc1)Br

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Saltdata: Cl-
Molecular Weight: 397.29
Empirical Formula: C18H23BrNO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.225
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 4

     

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