COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK432421
Chemical Name: 2-(1,3-benzodioxol-5-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]quinoline-4-carboxamide
Smiles: COc1cc(CCNC(=O)c2cc(nc3c2cccc3)c2ccc3c(c2)OCO3)ccc1OC

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Molecular Weight: 456.5
Empirical Formula: C27H24N2O5

Physical State: Dry powder
Available Amount: 800 mg

Lipinsky:
logP: 4.386
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 78
Number of rings: 5

     

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