COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK145656
Chemical Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethoxyphenyl)ethanamine
Smiles: COc1cc(CCNCc2ccc3c(c2)OCO3)ccc1OC

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Molecular Weight: 315.37
Empirical Formula: C18H21NO4

Physical State: Dry powder
Available Amount: 143 mg

Lipinsky:
logP: 3.175
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 48
Number of rings: 3

     

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