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Compound InformationSONAR Target prediction
Name:

GANGALEOIDIN

Unique Identifier:SPE00200035
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:399.094 g/mol
X log p:4.46  (online calculus)
Lipinksi Failures0
TPSA71.06
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:7
Rotatable Bond Count:3
Canonical Smiles:COC(=O)c1c(C)c2Oc3c(Cl)c(O)c(Cl)c(C)c3C(=O)Oc2cc1OC
Class:depsidone
Source:Lecanora gangaleoides
Reference:J Chem Soc 1986: 1491

Found: 192 nonactive | as graph: single | with analogs [1] << Back 181 182 183 184 185 186 187 188 189 190  Next >> [192]
Species: 4932
Condition: TEP1
Replicates: 2
Raw OD Value: r im 0.5812±0.0122329
Normalized OD Score: sc h 0.8897±0.0191362
Z-Score: -2.9600±0.690084
p-Value: 0.00699904
Z-Factor: -0.5725
Fitness Defect: 4.962
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:24|A6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.40 Celcius
Date:2005-12-23 YYYY-MM-DD
Plate CH Control (+):0.039875±0.00227
Plate DMSO Control (-):0.5946750000000001±0.02447
Plate Z-Factor:0.8345
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DBLink | Rows returned: 1
4565183

internal high similarity DBLink | Rows returned: 3
SPE00300222 0.9235
SPE00200033 0.9326
SPE00241150 0.9389

active | Cluster 8052 | Additional Members: 2 | Rows returned: 0
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