COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK334366
Chemical Name: (2E,2'E)-1,1'-(1,4-diazepane-1,4-diyl)bis[3-(1,3-benzodioxol-5-yl)prop-2-en-1-one]
Smiles: O=C(N1CCCN(CC1)C(=O)/C=C/c1ccc2c(c1)OCO2)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 448.48
Empirical Formula: C25H24N2O6

Physical State: Dry powder
Available Amount: 774 mg

Lipinsky:
logP: 3.674
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 77
Number of rings: 5

     

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