COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK540345
Chemical Name: 2-{2-[4-(thiophen-2-ylsulfonyl)piperazin-1-yl]ethyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: O=c1c2cccc3c2c(c(=O)n1CCN1CCN(CC1)S(=O)(=O)c1cccs1)ccc3

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Molecular Weight: 455.56
Empirical Formula: C22H21N3O4S2

Physical State: Dry powder
Available Amount: 390 mg

Lipinsky:
logP: 2.374
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 114
Number of rings: 5

     

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