COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL356789
Chemical Name: (2E)-4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-oxobut-2-enoicacid
Smiles: OC(=O)/C=C/C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 318.33
Empirical Formula: C16H18N2O5

Available Amount: 0 mg

Lipinsky:
logP: 0.607
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 79
Number of rings: 3

     

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