COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK512733
Chemical Name: N-[4-(1,3-benzodioxol-5-ylmethoxy)benzyl]prop-2-en-1-amine
Smiles: C=CCNCc1ccc(cc1)OCc1ccc2c(c1)OCO2

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Saltdata: HCl
Molecular Weight: 297.35
Empirical Formula: C18H19NO3

Physical State: Dry powder
Available Amount: 198 mg

Lipinsky:
logP: 3.692
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 39
Number of rings: 3

     

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