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Compound InformationSONAR Target prediction
Name:

LEOIDIN

Unique Identifier:SPE00200033
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:399.094 g/mol
X log p:2.513  (online calculus)
Lipinksi Failures0
TPSA61.83
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:7
Rotatable Bond Count:2
Canonical Smiles:COC(=O)c1c(C)c2Oc3c(Cl)c(O)c(Cl)c(C)c3C(=O)Oc2c(C)c1O
Class:depsidone
Source:lichen metabolite
Reference:J Chem Soc 1986: 1491

Found: 425 nonactive | as graph: single | with analogs [1] << Back 411 412 413 414 415 416 417 418 419 420  Next >> [425]
Species: 4932
Condition: IRE1
Replicates: 2
Raw OD Value: r im 0.7570±0.000494975
Normalized OD Score: sc h 0.9874±0.000850199
Z-Score: 1.8448±0.10274
p-Value: 0.065783
Z-Factor: -1.60288
Fitness Defect: 2.7214
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:15|C10
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2010-08-10 YYYY-MM-DD
Plate CH Control (+):0.09950000000000002±0.00698
Plate DMSO Control (-):0.94575±0.01640
Plate Z-Factor:0.9371
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DBLink | Rows returned: 1
3503223

internal high similarity DBLink | Rows returned: 2
SPE00200035 0.9326
SPE00241150 0.9722

active | Cluster 259 | Additional Members: 4 | Rows returned: 2
SPE01400422 0.442622950819672
SPE00241150 0

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