COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK841874
Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)butanamide
Smiles: COc1cc(CCNC(=O)CCCn2c(=O)c3cccc4c3c(c2=O)ccc4)ccc1OC

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Molecular Weight: 446.5
Empirical Formula: C26H26N2O5

Physical State: Dry powder
Available Amount: 494 mg

Lipinsky:
logP: 2.353
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 84
Number of rings: 4

     

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