COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK586640
Chemical Name: 2-(1,3-benzodioxol-5-yl)-2,3,6,7,11,12-hexahydro-4H,10H-[1,4]dioxepino[2,3-g]pyrido[2,1-a]isoquinolin-4-one
Smiles: O=C1CC(C=C2N1CCc1c2cc2c(c1)OCCCO2)c1ccc2c(c1)OCO2

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Molecular Weight: 391.42
Empirical Formula: C23H21NO5

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 2.865
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 57
Number of rings: 6

     

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