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Compound InformationSONAR Target prediction
Name:

PERSEITOL

Unique Identifier:SPE00202130
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:196.071 g/mol
X log p:-3.419  (online calculus)
Lipinksi Failures0
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:7
Rotatable Bond Count:6
Canonical Smiles:OCC(O)C(O)C(O)C(O)C(O)CO
Class:carbohydrate
Source:Persia spp.
Reference:J Am Chem Soc 61: 339 (1939); Carbohydr Res 150: 35 (1986)

Found: 205 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [205]
Species: 4932
Condition: BIK1
Replicates: 2
Raw OD Value: r im 0.6483±0.0129401
Normalized OD Score: sc h 0.9735±0.00332095
Z-Score: -1.1604±0.154817
p-Value: 0.24871
Z-Factor: -16.8313
Fitness Defect: 1.3915
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:4|A11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.60 Celcius
Date:2007-11-08 YYYY-MM-DD
Plate CH Control (+):0.041075±0.00102
Plate DMSO Control (-):0.6574249999999999±0.11402
Plate Z-Factor:0.3803
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DBLink | Rows returned: 103<< Back 11 12 13 14 15 16 17 18 Next >> 
2754252 (3S,5R,6S,10R,13R,17R)-10,13-dimethyl-17-[(2S)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-te
tradecahydrocyclopenta[a]phenanthrene-3,5,6-triol
2825542 (5R)-10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[
a]phenanthrene-3,5,6-triol
3025956 5-butylcyclohexane-1,2,3,5-tetrol
3036251 (3S,5R,6R,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methyl-heptan-2-yl]-10,13-dimethyl-1,2,3,4,6,7,8,
9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5,6-triol
3042238 n/a
3042239 n/a

internal high similarity DBLink | Rows returned: 2
SPE01504117 0.9375
NRB 03774 1.0000

active | Cluster 2846 | Additional Members: 7 | Rows returned: 0

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