COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK972582
Chemical Name: 2-({1-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: OC(CN1CCC(CC1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3)COc1c(C)cccc1C

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Saltdata: HCl
Molecular Weight: 472.58
Empirical Formula: C29H32N2O4

Available Amount: 0 mg

Lipinsky:
logP: 4.739
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 70
Number of rings: 5

     

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