COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK930345
Chemical Name: 3-(4-methylpiperazin-1-yl)-4-[(pyridin-4-ylmethyl)amino]cyclobut-3-ene-1,2-dione
Smiles: CN1CCN(CC1)C1=C(C(=O)C1=O)NCc1ccncc1

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Molecular Weight: 286.33
Empirical Formula: C15H18N4O2

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: -0.507
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 65
Number of rings: 3

     

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