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

Compound InformationSONAR Target prediction
Name:

HAEMATOMMIC ACID

Unique Identifier:SPE01400131
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:188.093 g/mol
X log p:3.966  (online calculus)
Lipinksi Failures0
TPSA34.14
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:2
Canonical Smiles:Cc1cc(O)c(C=O)c(O)c1C(O)=O
Class:aromatic
Source:Alectoria spp, Haematomma spp and Lethariella spp
Reference:J Org Chem 42: 2526 (1977); Helv Chim Acta 72: 1061 (1989)

Found: 204 nonactive | as graph: single | with analogs [1] << Back 41 42 43 44 45 46 47 48 49 50  Next >> [204]
Species: 4932
Condition: IDH2
Replicates: 2
Raw OD Value: r im 0.6090±0.00813173
Normalized OD Score: sc h 1.0332±0.0114496
Z-Score: 1.6553±0.533079
p-Value: 0.121615
Z-Factor: -2.59759
Fitness Defect: 2.1069
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:9|B11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.80 Celcius
Date:2007-10-19 YYYY-MM-DD
Plate CH Control (+):0.04075±0.00052
Plate DMSO Control (-):0.57975±0.01611
Plate Z-Factor:0.9112
png
ps
pdf

DBLink | Rows returned: 1
6710680 3-formyl-2,4-dihydroxy-6-methyl-benzoic acid

internal high similarity DBLink | Rows returned: 1
SPE00200640 0.9259

active | Cluster 3139 | Additional Members: 3 | Rows returned: 1
SPE00205071 0.446808510638298

Service provided by the Mike Tyers Laboratory