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 481 482 483 484 485 486 487 488 489 490  Next >> [604]
Species: 4932
Condition: SWR1
Replicates: 2
Raw OD Value: r im 0.6415±0.00657609
Normalized OD Score: sc h 0.9821±0.00932913
Z-Score: -0.7370±0.385194
p-Value: 0.477498
Z-Factor: -8.56468
Fitness Defect: 0.7392
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:13|G3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.10 Celcius
Date:2008-01-31 YYYY-MM-DD
Plate CH Control (+):0.040675±0.00129
Plate DMSO Control (-):0.6263000000000001±0.01429
Plate Z-Factor:0.9303
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