COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK115756
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-N-(octan-2-yl)prop-2-enamide
Smiles: CCCCCCC(NC(=O)/C=C/c1ccc2c(c1)OCO2)C

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Molecular Weight: 303.4
Empirical Formula: C18H25NO3

Physical State: Dry powder
Available Amount: 586 mg

Lipinsky:
logP: 5.107
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 47
Number of rings: 2

     

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