COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL243803
Chemical Name: 2-{2-[4-(2-cyanoethyl)piperazin-1-yl]-2-oxoethyl}benzoicacid
Smiles: N#CCCN1CCN(CC1)C(=O)Cc1ccccc1C(=O)O

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Molecular Weight: 301.35
Empirical Formula: C16H19N3O3

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 0.65
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 84
Number of rings: 2

     

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