COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK806615
Chemical Name: ethyl2-{[4-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)butanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCCn2c(=O)c3cccc4c3c(c2=O)ccc4)sc2c1CCCC2

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Molecular Weight: 490.58
Empirical Formula: C27H26N2O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.343
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 121
Number of rings: 5

     

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