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

Compound InformationSONAR Target prediction
Name:

BRAZILEIN

Unique Identifier:SPE00200463
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:272.168 g/mol
X log p:9.862  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:0
Canonical Smiles:Oc1ccc2c(OCC3(O)Cc4cc(=O)c(O)cc4=C23)c1
Class:quinone methide
Source:Caesalpinia spp
Reference:Phytochemistry 46: 177 (1997)

Found: 205 nonactive as graph: single | with analogs [1] << Back 21 22 23 24 25 26 27 28 29 30  Next >> [205]
Species: 4932
Condition: CTF18
Replicates: 2
Raw OD Value: r im 0.5827±0.00183848
Normalized OD Score: sc h 0.9959±0.00964539
Z-Score: -0.1593±0.413699
p-Value: 0.772702
Z-Factor: -37.1004
Fitness Defect: 0.2579
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:3|G4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.10 Celcius
Date:2007-11-01 YYYY-MM-DD
Plate CH Control (+):0.041425000000000003±0.00060
Plate DMSO Control (-):0.5799000000000001±0.01859
Plate Z-Factor:0.8854
png
ps
pdf

DBLink | Rows returned: 1
6453902

internal high similarity DBLink | Rows returned: 0

active | Cluster 968 | Additional Members: 2 | Rows returned: 1
SPE01502253 0

Service provided by the Mike Tyers Laboratory