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

Compound InformationSONAR Target prediction
Name:

DIHYDRO-beta-TUBAIC ACID

Unique Identifier:SPE00211531
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C13H16O4
Molecular Weight:220.137 g/mol
X log p:3.884  (online calculus)
Lipinksi Failures0
TPSA35.53
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:2
Canonical Smiles:COc1c2CCC(C)(C)Oc2ccc1C(O)=O
Source:derivative ex mundulone

Found: 509 nonactive | as graph: single | with analogs [1] << Back 191 192 193 194 195 196 197 198 199 200  Next >> [509]
Species: 4932
Condition: SPE01500451
Replicates: 2
Raw OD Value: r im 0.6902±0.00982878
Normalized OD Score: sc h 1.0107±0.00695842
Z-Score: 0.6221±0.447694
p-Value: 0.553954
Z-Factor: -12.8228
Fitness Defect: 0.5907
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SpectrumTMP
Plate Number and Position:1|E5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.70 Celcius
Date:2007-01-04 YYYY-MM-DD
Plate CH Control (+):0.039525000000000005±0.00187
Plate DMSO Control (-):0.66245±0.02985
Plate Z-Factor:0.7985
png
ps
pdf

DBLink | Rows returned: 1
3548249 5-methoxy-2,2-dimethyl-chroman-6-carboxylic acid

internal high similarity DBLink | Rows returned: 0

active | Cluster 8617 | Additional Members: 1 | Rows returned: 0

Service provided by the Mike Tyers Laboratory