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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: 15 active | as graph: single | with analogs << Back 1 2 3 4 5 6 7 8 9 10  Next >> 
Species: 4932
Condition: MCK1
Replicates: 2
Raw OD Value: r im 0.4840±0.022486
Normalized OD Score: sc h 0.8377±0.0251988
Z-Score: -6.9528±1.61369
p-Value: 0.00000000309088
Z-Factor: -4.28511
Fitness Defect: 19.5948
Bioactivity Statement: Active
Experimental Conditions
Library:Spectrum
Plate Number and Position:24|A6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.60 Celcius
Date:2007-11-13 YYYY-MM-DD
Plate CH Control (+):0.039575±0.00040
Plate DMSO Control (-):0.5710500000000001±0.10856
Plate Z-Factor:0.3479
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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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