COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK856901
Chemical Name: (2E)-1-[2-(benzyloxy)phenyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-en-1-one
Smiles: O=C(c1ccccc1OCc1ccccc1)/C=C/c1ccc2c(c1)OCCCO2

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Molecular Weight: 386.45
Empirical Formula: C25H22O4

Physical State: Dry powder
Available Amount: 266 mg

Lipinsky:
logP: 5.547
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 44
Number of rings: 4

     

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