COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552766
Chemical Name: (1R,5S,1'R,5'S)-3,3'-[(1-phenyl-1,2,3,4-tetrahydronaphthalene-1,4-diyl)bis(carbonyloxy)]bis(8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octane)
Smiles: CC[N+]1(C)[C@@H]2CC[C@H]1CC(C2)OC(=O)C1CCC(c2c1cccc2)(C(=O)OC1C[C@@H]2CC[C@H](C1)[N+]2(C)CC)c1ccccc1

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Saltdata: 2 Cl-
Molecular Weight: 600.84
Empirical Formula: C38H52N2O4

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 0.08
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 52
Number of rings: 7

     

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