COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056538
Chemical Name: (5E)-1-benzyl-2,6-dioxo-5-(1-{[2-(piperidinium-1-yl)ethyl]amino}ethylidene)-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: O=C1N=C([O-])/C(=C(\NCC[NH+]2CCCCC2)/C)/C(=O)N1Cc1ccccc1

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Molecular Weight: 370.45
Empirical Formula: C20H26N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.264
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 89
Number of rings: 3

     

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