COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK806693
Chemical Name: 2-{[3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propyl]sulfanyl}pyridine-3-carboxylicacid
Smiles: OC(=O)c1cccnc1SCCCn1c(=O)c2cccc3c2c(c1=O)ccc3

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Molecular Weight: 392.44
Empirical Formula: C21H16N2O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.633
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 4

     

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