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

Compound InformationSONAR Target prediction
Name:

9-HYDROXYPTEROCARPIN

Unique Identifier:SPE01401019
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C17H14O6
Molecular Weight:300.178 g/mol
X log p:10.51  (online calculus)
Lipinksi Failures1
TPSA46.15
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:1
Canonical Smiles:COc1ccc2C3Oc4cc5OCOc5cc4C3COc2c1O
Source:ex Derris spruceana; mp 213-215

Found: 100 nonactive | as graph: single | with analogs [1] << Back 91 92 93 94 95 96 97 98 99 100 Next >> [100]
Species: 4932
Condition: VPS5
Replicates: 2
Raw OD Value: r im 0.8354±0.00431335
Normalized OD Score: sc h 1.0016±0.00428034
Z-Score: 0.0897±0.233282
p-Value: 0.8695
Z-Factor: -180.466
Fitness Defect: 0.1398
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:24|A9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.00 Celcius
Date:2006-03-30 YYYY-MM-DD
Plate CH Control (+):0.040675±0.00226
Plate DMSO Control (-):0.8237000000000001±0.00847
Plate Z-Factor:0.9632
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 1
SPE00201654 0.9691

active | Cluster 10591 | Additional Members: 3 | Rows returned: 2
SPE00100743 0.567164179104478
SPE00201654 0

Service provided by the Mike Tyers Laboratory