Compound Information | SONAR Target prediction | Name: | Citicoline sodium | Unique Identifier: | LOPAC 00475 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | C13H23N4NaO11P2 | Molecular Weight: | 473.097 g/mol | X log p: | 0.115 (online calculus) | Lipinksi Failures | 1 | TPSA | 169.47 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 15 | Rotatable Bond Count: | 9 | Canonical Smiles: | [Na+].[O-]P(=O)(OCC1OC(C(O)C1O)N1C=CC(N)=NC1=O)OP([O-])(=O)OCN(C)(C)C | Class: | Lipid | Action: | Inhibitor | Selectivity: | PLA2 |
Species: |
4932 |
Condition: |
ESC2 |
Replicates: |
2 |
Raw OD Value: r im |
0.4837±0.0033234 |
Normalized OD Score: sc h |
0.9745±0.005917 |
Z-Score: |
-0.8000±0.235069 |
p-Value: |
0.430092 |
Z-Factor: |
-126.98 |
Fitness Defect: |
0.8438 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Lopac | Plate Number and Position: | 3|H8 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 28.20 Celcius | Date: | 2005-11-25 YYYY-MM-DD | Plate CH Control (+): | 0.03905±0.00228 | Plate DMSO Control (-): | 0.53555±0.03017 | Plate Z-Factor: | 0.7853 |
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DBLink | Rows returned: 2 | |
6604068 |
sodium [[[(2S,3S,4S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-oxido-phosphoryl]oxy -oxido-phosphoryl]oxymethyl-trimethyl-azanium |
6604069 |
[[[(2S,3S,4S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]o xy-hydroxy-phosphoryl]oxymethyl-trimethyl-azanium |
internal high similarity DBLink | Rows returned: 1 | |
active | Cluster 7710 | Additional Members: 3 | Rows returned: 0 | |
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