COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052663
Chemical Name: (5E)-1-benzyl-2,6-dioxo-5-(1-{[2-(piperidinium-1-yl)ethyl]amino}propylidene)-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)[O-])/NCC[NH+]1CCCCC1

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Molecular Weight: 384.48
Empirical Formula: C21H28N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.795
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 89
Number of rings: 3

     

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