COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK572062
Chemical Name: (2E)-1-(4-phenoxyphenyl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanone
Smiles: O=C(c1ccc(cc1)Oc1ccccc1)/C=C\1/NCCc2c1cc1OCCCOc1c2

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Molecular Weight: 413.47
Empirical Formula: C26H23NO4

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 5.939
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 56
Number of rings: 5

     

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