COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL513012
Chemical Name: (2E)-1-[2-(benzyloxy)-4-methoxyphenyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-en-1-one
Smiles: COc1ccc(c(c1)OCc1ccccc1)C(=O)/C=C/c1ccc2c(c1)OCCCO2

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Molecular Weight: 416.47
Empirical Formula: C26H24O5

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 5.594
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 53
Number of rings: 4

     

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