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

Compound InformationSONAR Target prediction
Name:

IRIGENOL

Unique Identifier:SPE00201182
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:308.156 g/mol
X log p:10.399  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:8
Rotatable Bond Count:1
Canonical Smiles:Oc1cc2OC=C(C(=O)c2c(O)c1O)c1cc(O)c(O)c(O)c1
Class:isoflavone
Source:Iris spp

Found: 72 active | as graph: single | with analogs [1] << Back 61 62 63 64 65 66 67 68 69 70  Next >> [72]
Species: 4932
Condition: NDI1
Replicates: 2
Raw OD Value: r im 0.5135±0.0395273
Normalized OD Score: sc h 0.7471±0.0467899
Z-Score: -11.7135±2.15726
p-Value: 1.1202e-24
Z-Factor: 0.156768
Fitness Defect: 55.1485
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:24|C11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:21.70 Celcius
Date:2008-03-13 YYYY-MM-DD
Plate CH Control (+):0.039375±0.00045
Plate DMSO Control (-):0.6643749999999999±0.01569
Plate Z-Factor:0.9300
png
ps
pdf

DBLink | Rows returned: 1
5781144 5,6,7-trihydroxy-3-(3,4,5-trihydroxyphenyl)chromen-4-one

internal high similarity DBLink | Rows returned: 7<< Back 1 2
SPE00200873 0.9161

active | Cluster 3206 | Additional Members: 1 | Rows returned: 0

Service provided by the Mike Tyers Laboratory