COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL409369
Chemical Name: 3-[4-(2-chlorobenzyl)piperazin-1-yl]-4-[(2-hydroxyethyl)amino]cyclobut-3-ene-1,2-dione
Smiles: OCCNC1=C(C(=O)C1=O)N1CCN(CC1)Cc1ccccc1Cl

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Molecular Weight: 349.82
Empirical Formula: C17H20ClN3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.034
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 72
Number of rings: 3

     

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