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Compound InformationSONAR Target prediction
Name:

N-Vanillylnonanamide

Unique Identifier:LOPAC 01291
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C17H27NO3
Molecular Weight:266.187 g/mol
X log p:6.381  (online calculus)
Lipinksi Failures2
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:11
Canonical Smiles:CCCCCCCCC(=O)NCc1ccc(O)c(OC)c1
Class:Vanilloid
Action:Ligand

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: NUM1
Replicates: 2
Raw OD Value: r im 0.7433±0.033729
Normalized OD Score: sc h 0.9941±0.013739
Z-Score: -0.3229±0.809084
p-Value: 0.586996
Z-Factor: -35.3045
Fitness Defect: 0.5327
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:16|B9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.90 Celcius
Date:2005-11-30 YYYY-MM-DD
Plate CH Control (+):0.038900000000000004±0.00045
Plate DMSO Control (-):0.75565±0.01352
Plate Z-Factor:0.9724
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DBLink | Rows returned: 14<< Back 1 2 3
5316427 N-[(4-hydroxy-3-methoxy-phenyl)methyl]octanamide
11727340 9-cyclopropyl-N-[(4-hydroxy-3-methoxy-phenyl)methyl]nonanamide

internal high similarity DBLink | Rows returned: 2
LOPAC 01026 1.0000
SPE02300192 1.0000

active | Cluster 16111 | Additional Members: 9 | Rows returned: 1
LOPAC 01216 0.528571428571429

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