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Compound InformationSONAR Target prediction
Name:

ASCORBIC ACID

Unique Identifier:SPE01502230
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:168.061 g/mol
X log p:0.412  (online calculus)
Lipinksi Failures0
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:2
Canonical Smiles:OCC(O)C1OC(=O)C(O)=C1O
Class:carbohydrate
Source:Vitamin C
Therapeutics:antiscorbutic, antiviral
Generic_name:ASCORBIC ACID
Chemical_iupac_name:ASCORBIC ACID
Drug_type:Experimental
Kegg_compound_id:C00072
Drugbank_id:EXPT00568
Melting_point:193oC
H2o_solubility:300 mg/mL
Logp:-1.305
Cas_registry_number:50-81-7
Drug_category:Hyaluronate Lyase inhibitor
Organisms_affected:-1

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: NPR1
Replicates: 2
Raw OD Value: r im 0.9498±0.0125158
Normalized OD Score: sc h 0.9319±0.00200077
Z-Score: -0.7637±0.259595
p-Value: 0.452686
Z-Factor: -0.305507
Fitness Defect: 0.7926
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:1|A7
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2012-09-18 YYYY-MM-DD
Plate CH Control (+):0.0081±0.00469
Plate DMSO Control (-):1.0006249999999999±0.02736
Plate Z-Factor:0.9248
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DBLink | Rows returned: 1
439374

internal high similarity DBLink | Rows returned: 0

active | Cluster 176 | Additional Members: 3 | Rows returned: 0

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