COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK616432
Chemical Name: (2Z)-1-[3-(phenoxymethyl)-1-benzofuran-2-yl]-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanone
Smiles: O=C(c1oc2c(c1COc1ccccc1)cccc2)/C=C/1\NCCc2c1cc1OCCCOc1c2

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Molecular Weight: 467.52
Empirical Formula: C29H25NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.35
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 69
Number of rings: 6

     

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