COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK594471
Chemical Name: 2-(4-ethoxyphenyl)-4-imino-6,7,11,12-tetrahydro-4H,10H-[1,4]dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: CCOc1ccc(cc1)c1cc2c3cc4OCCCOc4cc3CCn2c(=N)c1C#N

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Molecular Weight: 413.48
Empirical Formula: C25H23N3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.204
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 78
Number of rings: 5

     

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