COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL152340
Chemical Name: 3-{[2-(4-methylpiperazin-1-yl)-2-phenylethyl]amino}-4-[(pyridin-4-ylmethyl)amino]cyclobut-3-ene-1,2-dione
Smiles: CN1CCN(CC1)C(c1ccccc1)CNC1=C(C(=O)C1=O)NCc1ccncc1

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Molecular Weight: 405.5
Empirical Formula: C23H27N5O2

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 0.086
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 77
Number of rings: 4

     

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