COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK978162
Chemical Name: methyl4-({4-[2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)ethyl]piperazin-1-yl}methyl)benzoate
Smiles: COC(=O)c1ccc(cc1)CN1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3

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Molecular Weight: 457.53
Empirical Formula: C27H27N3O4

Available Amount: 0 mg

Lipinsky:
logP: 2.176
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 70
Number of rings: 5

     

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