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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 31 32 33 34 35 36 37 38 39 40  Next >> [205]
Species: 4932
Condition: GIM3
Replicates: 2
Raw OD Value: r im 0.7640±0.000848528
Normalized OD Score: sc h 1.0312±0.0159855
Z-Score: 0.9665±0.435554
p-Value: 0.356338
Z-Factor: -6.21957
Fitness Defect: 1.0319
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:4|A11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.50 Celcius
Date:2006-03-15 YYYY-MM-DD
Plate CH Control (+):0.038724999999999996±0.00175
Plate DMSO Control (-):0.715375±0.03372
Plate Z-Factor:0.8129
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DBLink | Rows returned: 103<< Back 11 12 13 14 15 16 17 18 Next >> 
3042885 n/a
3081764 (2S,3R,5R,6S)-norbornane-2,3,5,6,7-pentol
3357661 10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5,6-triol
3737657 5-(hydroxymethyl)cyclohexane-1,2,3-triol
4369066 (1S,2R,3R,4R)-4-(hydroxymethyl)cyclohexane-1,2,3-triol
5315346 heptane-1,3,4,5,7-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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