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

Compound InformationSONAR Target prediction
Name:

ISOXICAM

Unique Identifier:SPE01503242
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:322.233 g/mol
X log p:10.866  (online calculus)
Lipinksi Failures1
TPSA84.42
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:3
Canonical Smiles:CN1C(C(=O)Nc2cc(C)on2)=C(O)c2ccccc2S1(=O)=O
Source:synthetic
Therapeutics:antiinflammatory

Found: 199 nonactive | as graph: single | with analogs [1] << Back 111 112 113 114 115 116 117 118 119 120  Next >> [199]
Species: 4932
Condition: CHS5
Replicates: 2
Raw OD Value: r im 0.7380±0.00678822
Normalized OD Score: sc h 0.9623±0.0120313
Z-Score: -1.8224±0.534602
p-Value: 0.0882078
Z-Factor: -1.06557
Fitness Defect: 2.4281
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:13|H8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.80 Celcius
Date:2006-03-28 YYYY-MM-DD
Plate CH Control (+):0.039025000000000004±0.00310
Plate DMSO Control (-):0.74915±0.00945
Plate Z-Factor:0.9610
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 16469 | Additional Members: 9 | Rows returned: 4
SPE01504150 0.353846153846154
Prest505 0.295081967213115
Prest573 0
SPE01500491 0

Service provided by the Mike Tyers Laboratory