COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK010424
Chemical Name: 1-(2-{[(3,6-dichloropyridin-2-yl)carbonyl]amino}ethyl)-1-{2-[(2-ethylpentyl)oxy]-2-oxoethyl}piperidinium
Smiles: CCCC(COC(=O)C[N+]1(CCCCC1)CCNC(=O)c1nc(Cl)ccc1Cl)CC

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Saltdata: Br-
Molecular Weight: 459.44
Empirical Formula: C22H34Cl2N3O3

Physical State: Dry powder
Available Amount: 115 mg

Lipinsky:
logP: 2.102
Rotatable bonds: 12
H-donors: 1
H-acceptors: 3
PSA: 68
Number of rings: 2

     

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