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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 201 202 203 204 205 Next >> [205]
Species: 4932
Condition: WHI5
Replicates: 2
Raw OD Value: r im 0.6245±0.000565685
Normalized OD Score: sc h 0.9730±0.00621876
Z-Score: -0.8696±0.315868
p-Value: 0.396292
Z-Factor: -6.05018
Fitness Defect: 0.9256
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:19|G11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.00 Celcius
Date:2008-09-16 YYYY-MM-DD
Plate CH Control (+):0.04075±0.00074
Plate DMSO Control (-):0.6675±0.02217
Plate Z-Factor:0.8945
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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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