COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL157180
Chemical Name: 4-(3,4-dioxo-2-{[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]amino}cyclobut-1-en-1-yl)piperazine-1-carbaldehyde
Smiles: O=CN1CCN(CC1)C1=C(C(=O)C1=O)NCc1c(C)nn(c1C)C

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Molecular Weight: 331.37
Empirical Formula: C16H21N5O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -1.226
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 87
Number of rings: 3

     

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