COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL155196
Chemical Name: 3-[4-(3,4-dioxo-2-{[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]amino}cyclobut-1-en-1-yl)piperazin-1-yl]propanenitrile
Smiles: N#CCCN1CCN(CC1)C1=C(C(=O)C1=O)NCc1c(C)nn(c1C)C

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Molecular Weight: 356.43
Empirical Formula: C18H24N6O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: -0.501
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 94
Number of rings: 3

     

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