COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL162813
Chemical Name: 4-[2-(cycloheptylamino)-3,4-dioxocyclobut-1-en-1-yl]piperazine-1-carbaldehyde
Smiles: O=CN1CCN(CC1)C1=C(C(=O)C1=O)NC1CCCCCC1

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Molecular Weight: 305.38
Empirical Formula: C16H23N3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.55
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 69
Number of rings: 3

     

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