Home | Screening data | Screen comparisons | Search for compounds | Structure search

Compound InformationSONAR Target prediction
Name:

NADIDE

Unique Identifier:SPE01500419
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:636.211 g/mol
X log p:8.399  (online calculus)
Lipinksi Failures3
TPSA183.37
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:20
Rotatable Bond Count:11
Canonical Smiles:[O-]P(=O)(OCC1OC(C(O)C1O)[n+]1cccc(c1)C(N)=O)OP(O)(=O)OCC1OC(C(O)C1O)n
1cnc2c(N)ncnc12
Source:synthetic
Therapeutics:alcohol and narcotic antagonist
Generic_name:3-ACETYLPYRIDINE ADENINE DINUCLEOTIDE
Chemical_iupac_name:3-ACETYLPYRIDINE ADENINE DINUCLEOTIDE
Drug_type:Experimental
Drugbank_id:EXPT00368
Drug_category:Lactate Dehydrogenase inhibitor
Organisms_affected:-1

Found: 205 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [205]
Species: 4932
Condition: HOG1
Replicates: 2
Raw OD Value: r im 0.6090±0.0113137
Normalized OD Score: sc h 0.9822±0.0173509
Z-Score: -0.4509±0.396679
p-Value: 0.664594
Z-Factor: -7.68429
Fitness Defect: 0.4086
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:4|A5
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2010-08-10 YYYY-MM-DD
Plate CH Control (+):0.09200000000000001±0.00867
Plate DMSO Control (-):0.74575±0.01925
Plate Z-Factor:0.8517
png
ps
pdf

DBLink | Rows returned: 30<< Back 1 2 3 4 5 Next >> 
445842 [[(2R,3R,4R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[[(2R,3R,4R,
5R)-5-(5-carbamoylpyridin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy]phosphinic acid
445941 [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[[(2R,3R,
4R)-5-(5-carbamoylpyridin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy]phosphinic acid
446251 [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[[(2S,3S,
4S,5R)-5-(5-carbamoylpyridin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy]phosphinic acid
447143 [[(2S,3R,4R,5S)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[[(2R,3R,
4R,5R)-5-(5-carbamoylpyridin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy]phosphinic acid
447631 [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[[(2S,3R,
4R,5R)-5-(5-carbamoylpyridin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy]phosphinic acid
447862 [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[[(2S,3S,
4S,5S)-5-(5-carbamoylpyridin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy]phosphinic acid

internal high similarity DBLink | Rows returned: 1
SPE01503902 0.9714

nonactive | Cluster 306 | Additional Members: 11 | Rows returned: 102 Next >> 
LOPAC 00455 0.491666666666667
LOPAC 00029 0.490384615384615
LOPAC 00702 0.477477477477477
LOPAC 01337 0.470588235294118
LOPAC 00015 0.466666666666667
LOPAC 00041 0.315789473684211

Service provided by the Mike Tyers Laboratory