COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL322745
Chemical Name: (2E)-1-[2,4-bis(methoxymethoxy)phenyl]-3-(6-chloro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one
Smiles: COCOc1cc(OCOC)ccc1C(=O)/C=C/c1cc(Cl)cc2c1OCOC2

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Molecular Weight: 420.85
Empirical Formula: C21H21ClO7

Physical State: Dry powder
Available Amount: 217 mg

Lipinsky:
logP: 2.493
Rotatable bonds: 9
H-donors: 0
H-acceptors: 7
PSA: 72
Number of rings: 3

     

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