COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK570862
Chemical Name: (5Z)-5-{[(1-benzylpiperidinium-4-yl)amino]methylidene}-1-(3,4-dimethylphenyl)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: O=C1N=C([O-])/C(=C/NC2CC[NH+](CC2)Cc2ccccc2)/C(=O)N1c1ccc(c(c1)C)C

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Molecular Weight: 432.52
Empirical Formula: C25H28N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.163
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 89
Number of rings: 4

     

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