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Compound InformationSONAR Target prediction
Name:

N6-Methyladenosine

Unique Identifier:LOPAC 00050
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C11H15N5O4
Molecular Weight:266.149 g/mol
X log p:3.289  (online calculus)
Lipinksi Failures0
TPSA49.55
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:9
Rotatable Bond Count:3
Canonical Smiles:CNc1ncnc2n(cnc12)C1OC(CO)C(O)C1O
Class:Adenosine
Action:Agonist

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 0.5056±0.0596325
Normalized OD Score: sc h 1.0080±0.0261099
Z-Score: 0.2247±0.441014
p-Value: 0.738236
Z-Factor: -4.23881
Fitness Defect: 0.3035
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:10|D9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.70 Celcius
Date:2005-04-08 YYYY-MM-DD
Plate CH Control (+):0.0449625±0.00068
Plate DMSO Control (-):0.6567000000000002±0.13731
Plate Z-Factor:-0.1642
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DBLink | Rows returned: 4
1869 2-(hydroxymethyl)-5-(6-methylaminopurin-9-yl)oxolane-3,4-diol
101382 (2R,3R,4S,5R)-2-(hydroxymethyl)-5-(6-methylaminopurin-9-yl)oxolane-3,4-diol
102175 (2R,3R,4R,5R)-2-(hydroxymethyl)-5-(6-methylaminopurin-9-yl)oxolane-3,4-diol
5284425 (2S,3S,4S,5R)-2-(hydroxymethyl)-5-(6-methylaminopurin-9-yl)oxolane-3,4-diol

internal high similarity DBLink | Rows returned: 4
SPE01500107 0.9091
SPE01500609 0.9091
BTB 14111 0.9241
LOPAC 00011 0.9430

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

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