COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051857
Chemical Name: (5E)-1-cyclohexyl-5-{1-[(4-methylpiperazin-4-ium-1-yl)amino]propylidene}-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)C1CCCCC1)[O-])/NN1CC[NH+](CC1)C

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Molecular Weight: 363.46
Empirical Formula: C18H29N5O3

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 1.048
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 92
Number of rings: 3

     

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