COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553110
Chemical Name: 1-{3-[(5S)-5-ethyl-2,5-dimethyl-3,4,4a,10b-tetrahydro-2H,5H-pyrano[3,2-c]chromen-2-yl]prop-2-yn-1-yl}-1-methylpiperidinium
Smiles: CC[C@]1(C)Oc2ccccc2C2C1CCC(O2)(C)C#CC[N+]1(C)CCCCC1

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Saltdata: I-
Molecular Weight: 382.57
Empirical Formula: C25H36NO2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.143
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 18
Number of rings: 4

     

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