COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK610187
Chemical Name: (3,4-diethoxyphenyl)(7-methylidene-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)methanone
Smiles: CCOc1cc(ccc1OCC)C(=O)N1CCc2c(C1=C)cc1c(c2)OCCCO1

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Molecular Weight: 409.48
Empirical Formula: C24H27NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.294
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 57
Number of rings: 4

     

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