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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 181 182 183 184 185 186 187 188 189 190  Next >> [205]
Species: 4932
Condition: UBP6
Replicates: 2
Raw OD Value: r im 0.6299±0.00551543
Normalized OD Score: sc h 0.9865±0.00182141
Z-Score: -0.5494±0.104818
p-Value: 0.58379
Z-Factor: -7.7418
Fitness Defect: 0.5382
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:11|G10
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.40 Celcius
Date:2008-01-24 YYYY-MM-DD
Plate CH Control (+):0.042249999999999996±0.00071
Plate DMSO Control (-):0.6043750000000001±0.01817
Plate Z-Factor:0.9095
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DBLink | Rows returned: 89<< Back 1 2 3 4 5 6 7 8 9 10  Next >> 
5367324 (4E)-cyclonon-4-en-1-ol
5367618 n/a
5371070 3-methyl-2-[(E)-pent-2-enyl]cyclopentan-1-ol
5377498 10,13-dimethyl-17-[(E)-6-methylhept-3-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclo
penta[a]phenanthren-16-ol
5377524 10,13-dimethyl-17-[(E)-6-methylhept-3-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclo
penta[a]phenanthren-16-ol
5461815 5-(1-cyclohex-2-enylmethyl)nonan-5-ol

internal high similarity DBLink | Rows returned: 92 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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