COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK598010
Chemical Name: (2Z)-1-(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(c1cc2c(o1)cccc2)/C=C/1\NCCc2c1cc1OCCCOc1c2

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Molecular Weight: 361.4
Empirical Formula: C22H19NO4

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 3.779
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 60
Number of rings: 5

     

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