COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK721996
Chemical Name: N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)prop-2-en-1-amine
Smiles: C=CCNCC1OCc2c(CO1)cccc2

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Molecular Weight: 219.28
Empirical Formula: C13H17NO2

Physical State: Dry powder
Available Amount: 181 mg

Lipinsky:
logP: 2.056
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 30
Number of rings: 2

     

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