COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807174
Chemical Name: 2-{4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxobutyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)CCCn1c(=O)c2cccc3c2c(c1=O)ccc3

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Molecular Weight: 461.95
Empirical Formula: C26H24ClN3O3

Physical State: Dry powder
Available Amount: 82 mg

Lipinsky:
logP: 3.377
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 60
Number of rings: 5

     

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