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

Compound InformationSONAR Target prediction
Name:

KETOTIFEN FUMARATE

Unique Identifier:SPE01500668
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:402.316 g/mol
X log p:12.903  (online calculus)
Lipinksi Failures1
TPSA45.61
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:0
Canonical Smiles:CN1CCC(CC1)=C1c2ccccc2CC(=O)c2sccc21.OC(=O)C=CC(O)=O
Source:synthetic
Therapeutics:antiasthmatic

Found: 205 nonactive as graph: single | with analogs [1] << Back 91 92 93 94 95 96 97 98 99 100  Next >> [205]
Species: 4932
Condition: BY4743
Replicates: 2
Raw OD Value: r im 0.9960±0
Normalized OD Score: sc h 0.9949±0
Z-Score: 0.7850±0
p-Value: 0.432464
Z-Factor: -6.12414
Fitness Defect: 0.8383
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:5|G2
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2012-05-28 YYYY-MM-DD
Plate CH Control (+):0.0985±0.00995
Plate DMSO Control (-):0.976±0.01594
Plate Z-Factor:0.9115
png
ps
pdf

DBLink | Rows returned: 2
36856
5282408

internal high similarity DBLink | Rows returned: 1
LOPAC 00997 1.0000

active | Cluster 4311 | Additional Members: 10 | Rows returned: 2
SPE01501114 0.571428571428571
SPE01505003 0.46875

Service provided by the Mike Tyers Laboratory