COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807831
Chemical Name: 2-{2-[4-(azepan-1-ylsulfonyl)phenyl]ethyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: O=c1c2cccc3c2c(c(=O)n1CCc1ccc(cc1)S(=O)(=O)N1CCCCCC1)ccc3

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Molecular Weight: 462.57
Empirical Formula: C26H26N2O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.077
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 83
Number of rings: 5

     

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