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

Compound InformationSONAR Target prediction
Name:

RAMELTEON

Unique Identifier:SPE01505817
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C16H21NO2
Molecular Weight:238.177 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:CCC(=O)NCCC1CCc2ccc3OCCc3c12
Source:synthetic; TAK-375; M-II
Therapeutics:melatonin receptor agonist

Found: 103 nonactive | as graph: single | with analogs [1] << Back 71 72 73 74 75 76 77 78 79 80  Next >> [103]
Species: 4932
Condition: SWE1
Replicates: 2
Raw OD Value: r im 0.7280±0.00954594
Normalized OD Score: sc h 1.0059±0.000188606
Z-Score: 0.3114±0.00837515
p-Value: 0.75551
Z-Factor: -54.886
Fitness Defect: 0.2804
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:8|B11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.80 Celcius
Date:2008-05-13 YYYY-MM-DD
Plate CH Control (+):0.040400000000000005±0.00059
Plate DMSO Control (-):0.6983750000000001±0.01773
Plate Z-Factor:0.9232
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 3341 | Additional Members: 1 | Rows returned: 0
Service provided by the Mike Tyers Laboratory