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

Compound InformationSONAR Target prediction
Name:

HEXAMETHYLQUERCETAGETIN

Unique Identifier:SPE01505383
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C21H22O8
Molecular Weight:380.22 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:COc1ccc(cc1OC)C1Oc2cc(OC)c(OC)c(OC)c2C(=O)C=1OC
Class:flavone
Source:Citrus spp
Reference:Phytochemistry 11:2283 (1972)

Found: 104 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [104]
Species: 4932
Condition: DOA4
Replicates: 2
Raw OD Value: r im 0.6424±0.0159099
Normalized OD Score: sc h 0.9723±0.0147839
Z-Score: -1.1042±0.608477
p-Value: 0.312648
Z-Factor: -3.03073
Fitness Defect: 1.1627
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:16|A5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.00 Celcius
Date:2008-05-02 YYYY-MM-DD
Plate CH Control (+):0.0405±0.00035
Plate DMSO Control (-):0.62475±0.01396
Plate Z-Factor:0.9352
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 7222 | Additional Members: 3 | Rows returned: 1
SPE01505380 0.259259259259259

Service provided by the Mike Tyers Laboratory