COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL151936
Chemical Name: 3-(4-acetylpiperazin-1-yl)-4-[(2-methoxybenzyl)amino]cyclobut-3-ene-1,2-dione
Smiles: COc1ccccc1CNC1=C(C(=O)C1=O)N1CCN(CC1)C(=O)C

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Molecular Weight: 343.38
Empirical Formula: C18H21N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.307
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 78
Number of rings: 3

     

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