COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK937405
Chemical Name: 3-[(1,3-benzodioxol-5-ylmethyl)amino]-4-(4-methylpiperazin-1-yl)cyclobut-3-ene-1,2-dione
Smiles: CN1CCN(CC1)C1=C(C(=O)C1=O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 329.36
Empirical Formula: C17H19N3O4

Physical State: Dry powder
Available Amount: 324 mg

Lipinsky:
logP: 0.847
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 4

     

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