COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK012872
Chemical Name: 1-(2-{[(2,4-dichlorophenoxy)acetyl]amino}ethyl)-1-[2-(octyloxy)-2-oxoethyl]piperidinium
Smiles: CCCCCCCCOC(=O)C[N+]1(CCCCC1)CCNC(=O)COc1ccc(cc1Cl)Cl

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Saltdata: Br-
Molecular Weight: 502.5
Empirical Formula: C25H39Cl2N2O4

Physical State: Dry powder
Available Amount: 244 mg

Lipinsky:
logP: 4.03
Rotatable bonds: 16
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 2

     

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