COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK570045
Chemical Name: (5E)-1-(4-fluorobenzyl)-4,6-dioxo-5-({[3-(piperidinium-1-yl)propyl]amino}methylidene)-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: Fc1ccc(cc1)CN1C(=NC(=O)/C(=C\NCCC[NH+]2CCCCC2)/C1=O)[S-]

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Molecular Weight: 404.51
Empirical Formula: C20H25FN4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.018
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 66
Number of rings: 3

     

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