COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050109
Chemical Name: (5E)-5-(1-{[3-(diethylammonio)propyl]amino}ethylidene)-1-(4-methoxyphenyl)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C(\NCCC[NH+](CC)CC)/C)/C1=O)[O-]

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Molecular Weight: 388.47
Empirical Formula: C20H28N4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.119
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 98
Number of rings: 2

     

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