COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL153052
Chemical Name: 3-(4-acetylpiperazin-1-yl)-4-{[2-(2-hydroxyethoxy)ethyl]amino}cyclobut-3-ene-1,2-dione
Smiles: OCCOCCNC1=C(C(=O)C1=O)N1CCN(CC1)C(=O)C

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Molecular Weight: 311.34
Empirical Formula: C14H21N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -2.124
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 99
Number of rings: 2

     

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