COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL152559
Chemical Name: 3-{4-[2-(benzylamino)-3,4-dioxocyclobut-1-en-1-yl]piperazin-1-yl}propanenitrile
Smiles: N#CCCN1CCN(CC1)C1=C(C(=O)C1=O)NCc1ccccc1

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Molecular Weight: 324.38
Empirical Formula: C18H20N4O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.63
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 76
Number of rings: 3

     

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