COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK099988
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]prop-2-en-1-one
Smiles: COc1ccccc1N1CCN(CC1)C(=O)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 366.42
Empirical Formula: C21H22N2O4

Physical State: Dry powder
Available Amount: 2332 mg

Lipinsky:
logP: 3.075
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 51
Number of rings: 4

     

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