COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL161911
Chemical Name: 3-(4-acetylpiperazin-1-yl)-4-{[2-(dimethylamino)-2-phenylethyl]amino}cyclobut-3-ene-1,2-dione
Smiles: CN(C(c1ccccc1)CNC1=C(C(=O)C1=O)N1CCN(CC1)C(=O)C)C

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Molecular Weight: 370.45
Empirical Formula: C20H26N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.792
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 72
Number of rings: 3

     

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