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

Compound InformationSONAR Target prediction
Name:

12a-HYDROXY-5-DEOXYDEHYDROMUNDUSERONE

Unique Identifier:SPE00202175
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:324.2 g/mol
X log p:13.364  (online calculus)
Lipinksi Failures1
TPSA46.15
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:3
Canonical Smiles:COc1ccc2C=C3c4cc(OC)c(OC)cc4OCC3(O)Oc2c1
Class:rotenoid
Source:derivative

Found: 604 nonactive | as graph: single | with analogs [1] << Back 551 552 553 554 555 556 557 558 559 560  Next >> [604]
Species: 4932
Condition: LGE1
Replicates: 2
Raw OD Value: r im 0.5688±0.0352139
Normalized OD Score: sc h 1.0197±0.00397961
Z-Score: 0.3364±0.0975546
p-Value: 0.737156
Z-Factor: -8.83166
Fitness Defect: 0.305
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:23|F4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.40 Celcius
Date:2006-02-08 YYYY-MM-DD
Plate CH Control (+):0.03925±0.00141
Plate DMSO Control (-):0.541525±0.04159
Plate Z-Factor:0.6830
png
ps
pdf

DBLink | Rows returned: 1
4620898

internal high similarity DBLink | Rows returned: 0

active | Cluster 1665 | Additional Members: 1 | Rows returned: 0
Service provided by the Mike Tyers Laboratory