COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK543732
Chemical Name: 2-[2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)ethyl]-4,5-dimethoxy-N-(pyridin-3-ylmethyl)benzenesulfonamide
Smiles: COc1cc(c(cc1OC)CCn1c(=O)c2cccc3c2c(c1=O)ccc3)S(=O)(=O)NCc1cccnc1

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Saltdata: H2O
Molecular Weight: 531.59
Empirical Formula: C28H25N3O6S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 3.196
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 123
Number of rings: 5

     

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