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Compound InformationSONAR Target prediction
Name:

NADPH tetrasodium

Unique Identifier:LOPAC 00455
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C21H26N7Na4O17P3
Molecular Weight:807.142 g/mol
X log p:5.025  (online calculus)
Lipinksi Failures3
TPSA288.89
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:24
Rotatable Bond Count:13
Canonical Smiles:[Na+].[Na+].[Na+].[Na+].[O-]P([O-])(=O)OC1C(O)C(COP([O-])(=O)OP([O-])(
=O)OCC2OC(C(O)C2O)N2C=CCC(=C2)C(N)=O)OC1n1cnc2c(N)ncnc12
Class:Nitric Oxide
Action:Cofactor
Generic_name:NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUC
Chemical_iupac_name:NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDEPHOSPHATE
Drug_type:Experimental
Drugbank_id:EXPT02321
Drug_category:Pteridine Reductase inhibitor
Organisms_affected:-1

Found: 24 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: GIM3
Replicates: 4
Raw OD Value: r im 0.4693±0.119716
Normalized OD Score: sc h 1.0167±0.00696876
Z-Score: 0.3939±0.236523
p-Value: 0.697804
Z-Factor: -3.49086
Fitness Defect: 0.3598
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:11|H9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.70 Celcius
Date:2005-04-08 YYYY-MM-DD
Plate CH Control (+):0.044700000000000004±0.00051
Plate DMSO Control (-):0.6080625±0.12359
Plate Z-Factor:0.1665
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DBLink | Rows returned: 7<< Back 1 2
15983949 1-[(2R,3R,4S,5R)-5-[[[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonatooxy-oxolan-2-yl]methox
y-oxido-phosphoryl]oxy-oxido-phosphoryl]oxymethyl]-3,4-dihydroxy-oxolan-2-yl]-4H-pyridine-3-carboxamide

internal high similarity DBLink | Rows returned: 0

active | Cluster 306 | Additional Members: 11 | Rows returned: 0

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