COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK672822
Chemical Name: N-(3,4-dimethoxybenzyl)-N-[2-(1,2,5-trimethyl-4-phenylpiperidin-4-yl)ethyl]propane-1,3-diamine
Smiles: NCCCN(Cc1ccc(c(c1)OC)OC)CCC1(CC(C)N(CC1C)C)c1ccccc1

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Saltdata: 3HCl
Molecular Weight: 453.67
Empirical Formula: C28H43N3O2

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 4.632
Rotatable bonds: 10
H-donors: 2
H-acceptors: 2
PSA: 50
Number of rings: 3

     

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