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

Compound InformationSONAR Target prediction
Name:

2-,3-DIHYDROXY-4,4-,6--TRIMETHOXYCHALCONE

Unique Identifier:SPE01505153
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C18H18O6
Molecular Weight:312.189 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:COc1cc(O)c(C(=O)C=Cc2ccc(OC)c(O)c2)c(OC)c1
Class:chalcone
Source:Merrillia caloxylon
Reference:Annalen 550:146 (1942); Planta 95:133 (1970); Phytochemistry 13:1561 (1974)

Found: 32 active | as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [32]
Species: 4932
Condition: ARL3
Replicates: 2
Raw OD Value: r im 0.5746±0.00827315
Normalized OD Score: sc h 0.8560±0.0236877
Z-Score: -6.8158±1.37178
p-Value: 0.00000000252038
Z-Factor: 0.18101
Fitness Defect: 19.7989
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:23|C7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.20 Celcius
Date:2008-06-11 YYYY-MM-DD
Plate CH Control (+):0.04085±0.00025
Plate DMSO Control (-):0.671025±0.01009
Plate Z-Factor:0.9430
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 9714 | Additional Members: 6 | Rows returned: 4
SPE00201610 0.527272727272727
SPE00201727 0.487179487179487
SPE00201081 0.458333333333333
SPE00200441 0

Service provided by the Mike Tyers Laboratory