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Compound InformationSONAR Target prediction
Name:

UVAOL

Unique Identifier:SPE01504073
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:392.32 g/mol
X log p:2.292  (online calculus)
Lipinksi Failures0
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:1
Canonical Smiles:CC1CCC2(CO)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1C
Class:triterpene
Source:Arctostaphylos spp, Leucothoe keiskei, Crataegus cuneata, Osmanthus fragrans, Ilex
latifolia
Reference:Bull Chem Soc Jpn 39:2313 (1966); J Pharm Sci 55:1378 (1966); Phytochemistry 6:1395
(1967)
Therapeutics:antineoplastic

Found: 205 nonactive as graph: single | with analogs [1] << Back 201 202 203 204 205 Next >> [205]
Species: 4932
Condition: MKK1
Replicates: 2
Raw OD Value: r im 0.7840±0
Normalized OD Score: sc h 0.9956±0.0197946
Z-Score: -0.1100±0.558492
p-Value: 0.694664
Z-Factor: -11.8246
Fitness Defect: 0.3643
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:19|H3
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2010-08-10 YYYY-MM-DD
Plate CH Control (+):0.104±0.00970
Plate DMSO Control (-):0.938±0.02802
Plate Z-Factor:0.8675
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DBLink | Rows returned: 89<< Back 1 2 3 4 5 6 7 8 9 10  Next >> 
556758
556761
557118
557144
557236
565067

internal high similarity DBLink | Rows returned: 91 2 Next >> 
SB 01792 0.9167
SPE00201697 0.9167
SPE00240449 0.9167
SPE00240470 0.9167
SPE01500843 0.9167
SPE00307057 0.9211

active | Cluster 1869 | Additional Members: 9 | Rows returned: 4
SPE00307045 0.452380952380952
SPE01505250 0.417721518987342
SPE01505175 0.324324324324324
SPE01800031 0

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