COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL488554
Chemical Name: 2-{2-[4-(3-butoxy-2-hydroxypropyl)piperazin-1-yl]ethyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: CCCCOCC(CN1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3)O

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Saltdata: 2HCI
Molecular Weight: 439.55
Empirical Formula: C25H33N3O4

Available Amount: 0 mg

Lipinsky:
logP: 2.265
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 73
Number of rings: 4

     

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