COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK805521
Chemical Name: N-(2-{[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]oxy}ethyl)-N,N-dimethyltricyclo[3.3.1.1~3,7~]decan-1-aminium
Smiles: COc1cc(/C=C/C(=O)OCC[N+](C23CC4CC(C3)CC(C2)C4)(C)C)ccc1OC

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Molecular Weight: 414.57
Empirical Formula: C25H36NO4

Physical State: Dry powder
Available Amount: 288 mg

Lipinsky:
logP: -1.517
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 44
Number of rings: 5

     

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