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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 21 22 23 24 25 26 27 28 29 30  Next >> [205]
Species: 4932
Condition: CNB1
Replicates: 2
Raw OD Value: r im 0.8160±0.0000707107
Normalized OD Score: sc h 1.0215±0.0323163
Z-Score: 1.0732±1.61327
p-Value: 0.486492
Z-Factor: -4.73809
Fitness Defect: 0.7205
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:4|A11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.80 Celcius
Date:2006-03-03 YYYY-MM-DD
Plate CH Control (+):0.0393±0.00780
Plate DMSO Control (-):0.8103250000000001±0.02102
Plate Z-Factor:0.9224
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DBLink | Rows returned: 103<< Back 1 2 3 4 5 6 7 8 9 10  Next >> 
540865 17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a
]phenanthrene-3,5,6,12-tetrol
547829 17-(6-hydroxy-5,6-dimethyl-heptan-2-yl)-10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydroc
yclopenta[a]phenanthrene-3,5,6-triol
552200 undecane-1,2,3,4,5-pentol
552345 tridecane-1,2,3,4,5-pentol
552346 dodecane-1,2,3,4,5-pentol
552347 tetradecane-1,2,3,4,5-pentol

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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