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

Compound InformationSONAR Target prediction
Name:

2-Chloroadenosine

Unique Identifier:LAT003B08
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C10ClH12N5O4
Molecular Weight:289.591 g/mol
X log p:1.286  (online calculus)
Lipinksi Failures0
TPSA49.55
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:9
Rotatable Bond Count:2
Canonical Smiles:Nc1nc(Cl)nc2n(cnc12)C1OC(CO)C(O)C1O

Found: 5 nonactive as graph: single | with analogs << Back 1 2 3 4 5 Next >> 
Species: 4932
Condition: wt18h
Replicates: 2
Raw OD Value: r im 0.7968±0.00148492
Normalized OD Score: sc h 1.0216±0.0132019
Z-Score: 0.6423±0.289109
p-Value: 0.529286
Z-Factor: -4.41762
Fitness Defect: 0.6362
Bioactivity Statement: Nonactive
Experimental Conditions
Library:LATCA
Plate Number and Position:3|B8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.80 Celcius
Date:2007-02-28 YYYY-MM-DD
Plate CH Control (+):0.04±0.00167
Plate DMSO Control (-):0.80105±0.01681
Plate Z-Factor:0.9253
png
ps
pdf

DBLink | Rows returned: 5
8974 (2R,3R,4R,5R)-2-(6-amino-2-chloro-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
235481 2-(6-amino-2-chloro-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
474900 (2S,3S,4R,5S)-2-(6-amino-2-chloro-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
6603778 (2R,3R,4R,5S)-2-(6-amino-2-chloro-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
11957496 (2R,4R,5R)-2-(6-amino-2-chloro-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol

internal high similarity DBLink | Rows returned: 1
LOPAC 00014 1.0000

active | Cluster 9750 | Additional Members: 25 | Rows returned: 4
Prest466 0.433333333333333
SPE01502238 0.423728813559322
SPE01500667 0.258620689655172
Prest983 0

Service provided by the Mike Tyers Laboratory