COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL156681
Chemical Name: tert-butyl(2-{[2-(4-methylpiperazin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}ethyl)carbamate
Smiles: CN1CCN(CC1)C1=C(C(=O)C1=O)NCCNC(=O)OC(C)(C)C

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Molecular Weight: 338.41
Empirical Formula: C16H26N4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.382
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 90
Number of rings: 2

     

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