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

Compound InformationSONAR Target prediction
Name:

4,4--DIMETHOXYDALBERGIONE

Unique Identifier:SPE00201448
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:268.18 g/mol
X log p:14.879  (online calculus)
Lipinksi Failures1
TPSA52.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:5
Canonical Smiles:COc1ccc(cc1)C(C=C)c1cc(=O)c(OC)cc1=O
Class:quinone
Source:Dalbergia nigra
Reference:Tetrahedron 21: 2683 (1965)

Found: 525 nonactive | as graph: single | with analogs [1] << Back 311 312 313 314 315 316 317 318 319 320  Next >> [525]
Species: 4932
Condition: SPE01504059
Replicates: 2
Raw OD Value: r im 0.6015±0.0247487
Normalized OD Score: sc h 0.9668±0.0149518
Z-Score: -0.4688±0.158653
p-Value: 0.641312
Z-Factor: -4.9402
Fitness Defect: 0.4442
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SpectrumTMP
Plate Number and Position:1|C4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:21.70 Celcius
Date:2006-11-17 YYYY-MM-DD
Plate CH Control (+):0.041124999999999995±0.02594
Plate DMSO Control (-):0.6299250000000001±0.03388
Plate Z-Factor:0.7876
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 2012 | Additional Members: 3 | Rows returned: 1
SPE00201092 0.234042553191489

Service provided by the Mike Tyers Laboratory