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Compound InformationSONAR Target prediction
Name:

3-deazaadenosine

Unique Identifier:LOPAC 00858
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C10H12N4O4
Molecular Weight:240.132 g/mol
X log p:5.389  (online calculus)
Lipinksi Failures1
TPSA49.55
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:8
Rotatable Bond Count:2
Canonical Smiles:OCC1OC(C(O)C1O)n1cnc2cncnc12
Class:Immune System
Action:Inhibitor

Found: 24 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [24]
Species: 4932
Condition: PAC10
Replicates: 2
Raw OD Value: r im 0.7113±0.00240416
Normalized OD Score: sc h 1.0283±0.0056897
Z-Score: 1.2857±0.242412
p-Value: 0.20513
Z-Factor: -2.46334
Fitness Defect: 1.5841
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:6|C4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.60 Celcius
Date:2005-04-15 YYYY-MM-DD
Plate CH Control (+):0.043899999999999995±0.00089
Plate DMSO Control (-):0.651125±0.02158
Plate Z-Factor:0.9034
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DBLink | Rows returned: 10<< Back 1 2
7349521 (2S,3R,4R,5S)-2-(hydroxymethyl)-5-purin-9-yl-oxolane-3,4-diol
7349522 (2S,3R,4R,5R)-2-(hydroxymethyl)-5-purin-9-yl-oxolane-3,4-diol
7349523 (2S,3R,4S,5S)-2-(hydroxymethyl)-5-purin-9-yl-oxolane-3,4-diol
7349524 (2S,3R,4S,5R)-2-(hydroxymethyl)-5-purin-9-yl-oxolane-3,4-diol

internal high similarity DBLink | Rows returned: 0

active | Cluster 16028 | Additional Members: 4 | Rows returned: 0

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